| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 33.6 | Very low | 55.6 | Low | 232 Ų | 232 | 152.9 Ų | 152.9 | 100% | 1.143 | 79% | 0.786 | S | S | * | * | 0 | 118.4 | 0 | -69.8 | -62.5 | -172.2 | 0 | 0 | 106.8 | |||||
| 2 | A | 42.8 | Very low | 56.4 | Low | 99 Ų | 99 | 154.5 Ų | 154.5 | 82% | 0.818 | 78% | 0.777 | S | S | * | * | trans | -97.9 | 111.6 | -178.1 | 0 | 0 | 0 | 0 | 0 | 109 | K4 | A2-K4 PolarHBondContact O-N 2.85Š| ||
| 3 | D | 46.9 | Very low | 56.9 | Low | 152 Ų | 152 | 156.9 Ų | 156.9 | 81% | 0.813 | 78% | 0.78 | S | S | * | * | trans | -75 | 111.9 | 178.9 | -65.3 | -43.4 | 0 | 0 | 0 | 110 | K5 | D3-K5 PolarHBondContact O-N 3.32Å; D3-K5 VanDerWaalsContact O-N 3.1Å | ||
| 4 | K | 50.7 | Low | 57.4 | Low | 205 Ų | 205 | 155.7 Ų | 155.7 | 89% | 0.891 | 77% | 0.774 | S | S | * | * | trans | -71.1 | 100.9 | 173.1 | -68 | 178.5 | 179.1 | 171.9 | 0 | 108.6 | A2 K6 | A2-K4 PolarHBondContact O-N 2.85Å; K4-K6 PolarHBondContact O-N 3.27Å | ||
| 5 | K | 58.9 | Low | 57.6 | Low | 204 Ų | 204 | 150 Ų | 150 | 89% | 0.887 | 76% | 0.755 | S | S | * | * | P | Polyproline II helix | trans | -63.9 | 122.6 | 168 | -69 | -168.7 | 179 | -178.3 | 0 | 108.9 | D3 | D3-K5 PolarHBondContact O-N 3.32Å; D3-K5 VanDerWaalsContact O-N 3.1Å |
| 6 | K | 62.8 | Low | 57.7 | Low | 195 Ų | 195 | 150.9 Ų | 150.9 | 85% | 0.848 | 75% | 0.748 | S | S | * | * | P | Polyproline II helix | trans | -67.5 | 134 | 173.4 | -64.6 | 172.5 | -176.2 | 169.5 | 0 | 108.1 | K4 D8 | K4-K6 PolarHBondContact O-N 3.27Å; K6-D8 PolarHBondContact O-N 2.84Å |
| 7 | P | 63.3 | Low | 57.6 | Low | 127 Ų | 127 | 151.1 Ų | 151.1 | 83% | 0.825 | 75% | 0.752 | S | S | * | * | P | Polyproline II helix | trans | -65.9 | 126.4 | 174 | 28 | -31.9 | 0 | 0 | 0 | 108.4 | S9 | P7-S9 PolarHBondContact O-N 3.08Š|
| 8 | D | 63.9 | Low | 57.4 | Low | 93 Ų | 93 | 150.7 Ų | 150.7 | 50% | 0.497 | 75% | 0.753 | S | S | . | * | P | Polyproline II helix | trans | -64.7 | 118.5 | 175.8 | -162.4 | 1.1 | 0 | 0 | 0 | 108.4 | K6 F10 H11 | K6-D8 PolarHBondContact O-N 2.84Å; D8-F10 PolarHBondContact O-N 3.09Å; D8-F10 WeakPolarHBondContact OD1-CD2 3.26Å; D8-H11 PolarHBondContact O-N 3.23Å; D8-H11 VanDerWaalsContact O-N 3.09Å |
| 9 | S | 64.4 | Low | 57.3 | Low | 97 Ų | 97 | 151.3 Ų | 151.3 | 68% | 0.678 | 76% | 0.758 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -65.2 | -10.6 | -170.7 | 69.4 | 0 | 0 | 0 | 0 | 113.1 | P7 | P7-S9 PolarHBondContact O-N 3.08Š|
| 10 | F | 59.4 | Low | 57.1 | Low | 153 Ų | 153 | 149.7 Ų | 149.7 | 67% | 0.671 | 76% | 0.762 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -78.7 | -14.5 | 176.7 | -67.8 | -75.6 | 0 | 0 | 0 | 113.8 | D8 | D8-F10 PolarHBondContact O-N 3.09Å; D8-F10 WeakPolarHBondContact OD1-CD2 3.26Å |
| 11 | H | 64.6 | Low | 56.8 | Low | 125 Ų | 125 | 149.4 Ų | 149.4 | 58% | 0.579 | 76% | 0.763 | S | S | * | * | H | α-helix | trans | -80.4 | -13.8 | 178.7 | -69 | -47.6 | 0 | 0 | 0 | 114.5 | D8 F13 | D8-H11 PolarHBondContact O-N 3.23Å; D8-H11 VanDerWaalsContact O-N 3.09Å; H11-F13 VanDerWaalsContact C-N 3.35Å |
| 12 | Y | 64.9 | Low | 57.2 | Low | 172 Ų | 172 | 144.2 Ų | 144.2 | 68% | 0.675 | 75% | 0.749 | S | S | * | * | H | α-helix | trans | -74.4 | -24.4 | -179.7 | -170.4 | -100.3 | 0 | 0 | 0 | 113.3 | ||
| 13 | F | 63.4 | Low | 57.1 | Low | 186 Ų | 186 | 144.3 Ų | 144.3 | 82% | 0.816 | 74% | 0.744 | S | S | * | * | H | α-helix | trans | -89.1 | -23.9 | 178.5 | -167.1 | -100.8 | 0 | 0 | 0 | 112.7 | H11 | H11-F13 VanDerWaalsContact C-N 3.35Å |
| 14 | M | 63.9 | Low | 56.7 | Low | 140 Ų | 140 | 145 Ų | 145 | 69% | 0.69 | 75% | 0.747 | S | S | * | * | H | α-helix | trans | -86.1 | -10.4 | -176.5 | -62 | -167.8 | 75.6 | 0 | 0 | 114.5 | Y16 | M14-Y16 VanDerWaalsContact C-N 3.27Å; M14-Y16 PolarHBondContact O-N 2.94Å |
| 15 | S | 59.9 | Low | 56.4 | Low | 70 Ų | 70 | 140.3 Ų | 140.3 | 49% | 0.49 | 74% | 0.74 | S | S | . | * | T | Hydrogen-bonded Turn | trans | -79.1 | -5.1 | -178.3 | 61.5 | 0 | 0 | 0 | 0 | 114.6 | ||
| 16 | Y | 59.1 | Low | 55.4 | Low | 164 Ų | 164 | 138.6 Ų | 138.6 | 64% | 0.643 | 74% | 0.741 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.8 | -7 | -177.8 | -70.6 | -80.6 | 0 | 0 | 0 | 113.8 | M14 | M14-Y16 VanDerWaalsContact C-N 3.27Å; M14-Y16 PolarHBondContact O-N 2.94Å |
| 17 | D | 56.4 | Low | 54.4 | Low | 154 Ų | 154 | 134.2 Ų | 134.2 | 82% | 0.824 | 74% | 0.735 | S | S | * | * | S | Bend | trans | -96.5 | -4.6 | -178.6 | -149.1 | 56.1 | 0 | 0 | 0 | 113.3 | ||
| 18 | D | 54.6 | Low | 53.1 | Low | 144 Ų | 144 | 133.1 Ų | 133.1 | 77% | 0.77 | 73% | 0.73 | S | S | * | * | trans | -100.7 | 30.9 | -175.2 | -166.8 | 37.6 | 0 | 0 | 0 | 113.9 | ||||
| 19 | L | 55.7 | Low | 51.8 | Low | 162 Ų | 162 | 135.6 Ų | 135.6 | 85% | 0.848 | 74% | 0.744 | S | S | * | * | trans | -121.1 | 33 | 176.2 | -65.5 | -179.4 | 0 | 0 | 0 | 113.3 | ||||
| 20 | S | 53.3 | Low | 50.7 | Low | 120 Ų | 120 | 135.5 Ų | 135.5 | 84% | 0.839 | 74% | 0.743 | S | S | * | * | trans | -120.4 | 57.3 | 173.5 | -170.9 | 0 | 0 | 0 | 0 | 112.4 | ||||
| 21 | D | 50.3 | Low | 49.8 | Very low | 144 Ų | 144 | 136 Ų | 136 | 77% | 0.77 | 75% | 0.752 | S | S | * | * | trans | -138.3 | 81.3 | 155.8 | -169.2 | 25.5 | 0 | 0 | 0 | 110.6 | ||||
| 22 | S | 41.3 | Very low | 48.4 | Very low | 123 Ų | 123 | 138.7 Ų | 138.7 | 86% | 0.86 | 77% | 0.765 | S | S | * | * | trans | -135.4 | 91.4 | 152.9 | -167 | 0 | 0 | 0 | 0 | 107.6 | ||||
| 23 | S | 41.9 | Very low | 47.3 | Very low | 101 Ų | 101 | 134.5 Ų | 134.5 | 71% | 0.706 | 77% | 0.766 | S | S | * | * | trans | -56.8 | 124.2 | 169.2 | -71.4 | 0 | 0 | 0 | 0 | 111.3 | ||||
| 24 | D | 38.9 | Very low | 45.9 | Very low | 165 Ų | 165 | 129.2 Ų | 129.2 | 88% | 0.882 | 76% | 0.764 | S | S | * | * | trans | -122.3 | 104.8 | 150 | -146.2 | -24.8 | 0 | 0 | 0 | 108.5 | ||||
| 25 | S | 43.1 | Very low | 44.6 | Very low | 107 Ų | 107 | 130.1 Ų | 130.1 | 75% | 0.748 | 77% | 0.767 | S | S | * | * | trans | -85.8 | 114 | -174.6 | 52.9 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 26 | N | 38.9 | Very low | 43.5 | Very low | 169 Ų | 169 | 134.4 Ų | 134.4 | 90% | 0.904 | 78% | 0.776 | S | S | * | * | trans | -125.4 | 128.6 | 157.7 | -149.4 | 11.4 | 0 | 0 | 0 | 112.1 | ||||
| 27 | S | 41 | Very low | 42.8 | Very low | 102 Ų | 102 | 136.3 Ų | 136.3 | 71% | 0.713 | 79% | 0.788 | S | S | * | * | trans | -91.1 | 170.5 | -164.5 | 174 | 0 | 0 | 0 | 0 | 112.5 | ||||
| 28 | S | 35.7 | Very low | 41.9 | Very low | 105 Ų | 105 | 134.9 Ų | 134.9 | 73% | 0.734 | 79% | 0.79 | S | S | * | * | trans | 85.9 | 135.7 | 165.4 | -81.8 | 0 | 0 | 0 | 0 | 116.7 | ||||
| 29 | D | 36.4 | Very low | 41.3 | Very low | 145 Ų | 145 | 140.3 Ų | 140.3 | 78% | 0.775 | 80% | 0.8 | S | S | * | * | cis | -167.7 | 142.8 | -7 | -154.3 | -64.3 | 0 | 0 | 0 | 104.4 | ||||
| 30 | S | 42.2 | Very low | 40.1 | Very low | 95 Ų | 95 | 136.5 Ų | 136.5 | 66% | 0.664 | 80% | 0.8 | S | S | * | * | trans | -91.8 | 133 | 173.4 | -86.1 | 0 | 0 | 0 | 0 | 108 | ||||
| 31 | D | 39.9 | Very low | 39.5 | Very low | 163 Ų | 163 | 141.2 Ų | 141.2 | 87% | 0.872 | 81% | 0.805 | S | S | * | * | 171.9 | 159.1 | 126.6 | -87.8 | -33.9 | 0 | 0 | 0 | 113.8 | |||||
| 32 | E | 36.5 | Very low | 38.6 | Very low | 182 Ų | 182 | 137.9 Ų | 137.9 | 85% | 0.85 | 81% | 0.805 | S | S | * | * | trans | 114.4 | 134.1 | 147.7 | -124.2 | -89 | 98.7 | 0 | 0 | 118.7 | ||||
| 33 | A | 39.9 | Very low | 38.4 | Very low | 84 Ų | 84 | 135.5 Ų | 135.5 | 69% | 0.694 | 80% | 0.8 | S | S | * | * | trans | -95.4 | 165.7 | -159.3 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 34 | G | 34.8 | Very low | 38 | Very low | 74 Ų | 74 | 137.2 Ų | 137.2 | 76% | 0.763 | 81% | 0.806 | S | S | * | * | trans | -172.5 | 64.6 | -178.2 | 0 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 35 | Q | 36.6 | Very low | 37.8 | Very low | 160 Ų | 160 | 137.4 Ų | 137.4 | 75% | 0.748 | 81% | 0.807 | S | S | * | * | trans | 37.2 | 128.1 | 137.3 | -70.7 | -159.2 | -10.6 | 0 | 0 | 123.4 | ||||
| 36 | K | 37.5 | Very low | 37.6 | Very low | 160 Ų | 160 | 136.8 Ų | 136.8 | 70% | 0.696 | 81% | 0.809 | S | S | * | * | 89.2 | 108.8 | 127.3 | -72.4 | 170.8 | -178.3 | 162.9 | 0 | 121.7 | |||||
| 37 | K | 43 | Very low | 37.6 | Very low | 204 Ų | 204 | 136 Ų | 136 | 89% | 0.887 | 81% | 0.811 | S | S | * | * | 37.4 | 123.8 | 121.7 | -57.2 | -172.5 | -178.4 | -178 | 0 | 119.2 | |||||
| 38 | S | 38.4 | Very low | 37.2 | Very low | 124 Ų | 124 | 134.6 Ų | 134.6 | 87% | 0.867 | 81% | 0.811 | S | S | * | * | -154.9 | 142.1 | 123.3 | 64.4 | 0 | 0 | 0 | 0 | 112.1 | |||||
| 39 | R | 41.3 | Very low | 37.6 | Very low | 257 Ų | 257 | 136 Ų | 136 | 97% | 0.97 | 82% | 0.822 | S | S | * | * | trans | -82.9 | 143.8 | 178.8 | -71.7 | 167 | 148.1 | 151.1 | -7.6 | 109.4 | ||||
| 40 | G | 32 | Very low | 37.4 | Very low | 83 Ų | 83 | 131.9 Ų | 131.9 | 86% | 0.856 | 81% | 0.813 | S | S | * | * | trans | -148.2 | 103.1 | 163.7 | 0 | 0 | 0 | 0 | 0 | 110 | ||||
| 41 | K | 39.1 | Very low | 37.6 | Very low | 218 Ų | 218 | 133.3 Ų | 133.3 | 95% | 0.948 | 82% | 0.823 | S | S | * | * | trans | -91.6 | 137.5 | 173 | 176.9 | 166.4 | 178.4 | 174.6 | 0 | 108 | ||||
| 42 | G | 31.6 | Very low | 37.5 | Very low | 74 Ų | 74 | 134.8 Ų | 134.8 | 76% | 0.763 | 82% | 0.822 | S | S | * | * | trans | 165.7 | 94 | 168.9 | 0 | 0 | 0 | 0 | 0 | 112 | ||||
| 43 | G | 36.6 | Very low | 37.9 | Very low | 74 Ų | 74 | 130.8 Ų | 130.8 | 76% | 0.763 | 81% | 0.814 | S | S | * | * | trans | -84.3 | 142.7 | 160.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||||
| 44 | T | 34.3 | Very low | 38.1 | Very low | 136 Ų | 136 | 132.6 Ų | 132.6 | 83% | 0.834 | 82% | 0.819 | S | S | * | * | trans | -161 | 124.1 | 149 | 45.9 | 0 | 0 | 0 | 0 | 107.7 | ||||
| 45 | D | 35.2 | Very low | 38.5 | Very low | 169 Ų | 169 | 137.8 Ų | 137.8 | 90% | 0.904 | 82% | 0.823 | S | S | * | * | trans | -51.1 | 133.6 | 159.3 | -70.4 | -65.8 | 0 | 0 | 0 | 110.7 | ||||
| 46 | A | 37.6 | Very low | 39 | Very low | 94 Ų | 94 | 139.4 Ų | 139.4 | 78% | 0.777 | 83% | 0.83 | S | S | * | * | trans | -148.6 | 101.9 | 159.8 | 0 | 0 | 0 | 0 | 0 | 108.6 | G48 | A46-G48 PolarHBondContact O-N 3.37Š| ||
| 47 | T | 39.4 | Very low | 39.2 | Very low | 154 Ų | 154 | 134.6 Ų | 134.6 | 95% | 0.945 | 83% | 0.826 | S | S | * | * | trans | -53.6 | 118.5 | 160.2 | 40.8 | 0 | 0 | 0 | 0 | 109.2 | ||||
| 48 | G | 34 | Very low | 39.6 | Very low | 71 Ų | 71 | 131.3 Ų | 131.3 | 73% | 0.732 | 82% | 0.823 | S | S | * | * | trans | -145.5 | 91.8 | -179.3 | 0 | 0 | 0 | 0 | 0 | 110.4 | A46 G50 | A46-G48 PolarHBondContact O-N 3.37Å; G48-G50 PolarHBondContact O-N 3.48Å | ||
| 49 | S | 43.5 | Very low | 40.2 | Very low | 136 Ų | 136 | 134.6 Ų | 134.6 | 95% | 0.951 | 82% | 0.822 | S | S | * | * | trans | -46.8 | 120.6 | 163.5 | 173.6 | 0 | 0 | 0 | 0 | 110.2 | ||||
| 50 | G | 32.3 | Very low | 40.8 | Very low | 57 Ų | 57 | 134.1 Ų | 134.1 | 59% | 0.588 | 82% | 0.82 | S | S | * | * | trans | -161.5 | 84.3 | 177.4 | 0 | 0 | 0 | 0 | 0 | 109.1 | G48 K52 | G48-G50 PolarHBondContact O-N 3.48Å; G50-K52 VanDerWaalsContact C-N 3.31Å; G50-K52 PolarHBondContact O-N 3.25Å | ||
| 51 | S | 45.5 | Very low | 41.8 | Very low | 125 Ų | 125 | 134 Ų | 134 | 87% | 0.874 | 81% | 0.812 | S | S | * | * | trans | -57.1 | 93.5 | 168.1 | 55.8 | 0 | 0 | 0 | 0 | 109.4 | ||||
| 52 | K | 38.3 | Very low | 42.9 | Very low | 194 Ų | 194 | 127.4 Ų | 127.4 | 84% | 0.843 | 80% | 0.797 | S | S | * | * | trans | -98.1 | 104.4 | 165.3 | -71.3 | -173.1 | 178.7 | -179 | 0 | 107.5 | G50 | G50-K52 VanDerWaalsContact C-N 3.31Å; G50-K52 PolarHBondContact O-N 3.25Å | ||
| 53 | S | 44.9 | Very low | 44.2 | Very low | 98 Ų | 98 | 130 Ų | 130 | 69% | 0.685 | 80% | 0.804 | S | S | * | * | trans | -42.6 | 131.8 | 160.3 | 49.9 | 0 | 0 | 0 | 0 | 110.2 | Q55 | S53-Q55 PolarHBondContact O-N 3.31Å; S53-Q55 VanDerWaalsContact O-N 3.08Å | ||
| 54 | P | 45.1 | Very low | 45.5 | Very low | 123 Ų | 123 | 130 Ų | 130 | 80% | 0.799 | 80% | 0.804 | S | S | * | * | trans | -74.7 | 107.9 | 172.4 | 29.9 | -27.6 | 0 | 0 | 0 | 107 | H56 | P54-H56 PolarHBondContact O-N 3.11Å; P54-H56 VanDerWaalsContact O-N 3.09Å | ||
| 55 | Q | 42.9 | Very low | 47.4 | Very low | 182 Ų | 182 | 126.9 Ų | 126.9 | 85% | 0.85 | 79% | 0.792 | S | S | * | * | trans | -58.8 | 115.5 | 162.9 | -73.6 | -175 | -65 | 0 | 0 | 107.1 | S53 G57 | S53-Q55 PolarHBondContact O-N 3.31Å; S53-Q55 VanDerWaalsContact O-N 3.08Å; Q55-G57 PolarHBondContact O-N 2.83Å | ||
| 56 | H | 46.6 | Very low | 49.6 | Very low | 194 Ų | 194 | 124.5 Ų | 124.5 | 90% | 0.898 | 79% | 0.785 | S | S | * | * | trans | -58.7 | 93.5 | 164.1 | -125.1 | -79 | 0 | 0 | 0 | 107.4 | P54 | P54-H56 PolarHBondContact O-N 3.11Å; P54-H56 VanDerWaalsContact O-N 3.09Å | ||
| 57 | G | 40.8 | Very low | 51.9 | Low | 60 Ų | 60 | 127.7 Ų | 127.7 | 62% | 0.619 | 79% | 0.789 | S | S | * | * | trans | -109.7 | 89.2 | 177.9 | 0 | 0 | 0 | 0 | 0 | 109 | Q55 K59 | Q55-G57 PolarHBondContact O-N 2.83Å; G57-K59 PolarHBondContact O-N 3.32Å | ||
| 58 | T | 51.8 | Low | 54.1 | Low | 134 Ų | 134 | 123.4 Ų | 123.4 | 82% | 0.822 | 76% | 0.763 | S | S | * | * | trans | -65.7 | 78.9 | 163.7 | 47.6 | 0 | 0 | 0 | 0 | 109.1 | ||||
| 59 | K | 51 | Low | 56.6 | Low | 193 Ų | 193 | 126.5 Ų | 126.5 | 84% | 0.839 | 76% | 0.757 | S | S | * | * | trans | -134.1 | 106.3 | 165.2 | -63.3 | -162 | -176.6 | -170.6 | 0 | 108.3 | G57 A61 | G57-K59 PolarHBondContact O-N 3.32Å; K59-A61 PolarHBondContact O-N 2.79Å | ||
| 60 | R | 54.6 | Low | 58.5 | Low | 247 Ų | 247 | 123.8 Ų | 123.8 | 93% | 0.932 | 74% | 0.736 | S | S | * | * | trans | -40.1 | 102.2 | 169.5 | -68.1 | 175.8 | -90.4 | -168.3 | -5.1 | 109.8 | A62 | R60-A62 PolarHBondContact O-N 3.37Š| ||
| 61 | A | 53.2 | Low | 60.9 | Low | 82 Ų | 82 | 126.7 Ų | 126.7 | 68% | 0.678 | 74% | 0.738 | S | S | * | * | trans | -84.8 | 65.5 | 154.8 | 0 | 0 | 0 | 0 | 0 | 106.9 | K59 | K59-A61 PolarHBondContact O-N 2.79Š| ||
| 62 | A | 62.3 | Low | 62.9 | Low | 78 Ų | 78 | 125.9 Ų | 125.9 | 65% | 0.645 | 72% | 0.721 | S | S | * | * | trans | -70.8 | 134.3 | 166.2 | 0 | 0 | 0 | 0 | 0 | 107.4 | R60 | R60-A62 PolarHBondContact O-N 3.37Š| ||
| 63 | S | 57.7 | Low | 65.1 | Low | 129 Ų | 129 | 121 Ų | 121 | 90% | 0.902 | 70% | 0.703 | S | S | * | * | S | Bend | trans | 74 | 59.8 | 171.8 | 80.6 | 0 | 0 | 0 | 0 | 119 | ||
| 64 | G | 63.6 | Low | 66.8 | Low | 75 Ų | 75 | 122.8 Ų | 122.8 | 77% | 0.773 | 70% | 0.699 | S | S | * | * | S | Bend | trans | 158.8 | -14.7 | 156.3 | 0 | 0 | 0 | 0 | 0 | 117.6 | ||
| 65 | A | 74.7 | Confident | 68.4 | Low | 69 Ų | 69 | 125.3 Ų | 125.3 | 57% | 0.57 | 70% | 0.697 | S | S | * | * | S | Bend | trans | -78.4 | 130.8 | 174.8 | 0 | 0 | 0 | 0 | 0 | 109.7 | ||
| 66 | P | 82.6 | Confident | 70.1 | Confident | 119 Ų | 119 | 121.5 Ų | 121.5 | 77% | 0.773 | 69% | 0.691 | S | S | * | * | P | Polyproline II helix | trans | -57.4 | 143.8 | 173.1 | 25.4 | -33 | 0 | 0 | 0 | 109.2 | ||
| 67 | L | 84.7 | Confident | 71.5 | Confident | 161 Ų | 161 | 116.6 Ų | 116.6 | 84% | 0.843 | 67% | 0.674 | S | S | * | * | P | Polyproline II helix | trans | -52 | 139 | 177.5 | -68.6 | 170.9 | 0 | 0 | 0 | 109.6 | K69 | L67-K69 PolarHBondContact O-N 3.44Š|
| 68 | P | 85.1 | Confident | 73.3 | Confident | 64 Ų | 64 | 118.9 Ų | 118.9 | 42% | 0.416 | 68% | 0.681 | S | S | . | * | P | Polyproline II helix | trans | -54.9 | 137.1 | 175.8 | 22.6 | -32.5 | 0 | 0 | 0 | 109.4 | E72 L73 | P68-E72 HydrophobicContact CB-CB 4.48Å; P68-L73 HydrophobicContact CB-CD2 4.21Å; P68-L73 HydrophobicContact CB-CG 4.32Å; P68-L73 HydrophobicContact CG-CD2 3.72Å; P68-L73 HydrophobicContact CG-CG 4.15Å |
| 69 | K | 87 | Confident | 74.6 | Confident | 136 Ų | 136 | 119.6 Ų | 119.6 | 59% | 0.591 | 67% | 0.673 | S | S | * | * | P | Polyproline II helix | trans | -58.2 | 147.5 | 177.8 | -71.3 | -179.9 | 179.4 | 176.3 | 0 | 109.2 | L67 D71 E72 L73 | L67-K69 PolarHBondContact O-N 3.44Å; K69-D71 PolarHBondContact O-N 3.18Å; K69-D71 VanDerWaalsContact O-N 3.14Å; K69-E72 HydrophobicContact CB-CG 4.23Å; K69-E72 WeakPolarHBondContact O-CA 3.47Å; K69-E72 WeakPolarHBondContact O-CB 3.22Å; K69-E72 PolarHBondContact O-N 2.98Å; K69-L73 PolarHBondContact O-N 3.21Å |
| 70 | P | 83.6 | Confident | 75.9 | Confident | 79 Ų | 79 | 113.3 Ų | 113.3 | 51% | 0.513 | 65% | 0.651 | S | S | . | * | H | α-helix | trans | -53.2 | -39.8 | 178.3 | 20.9 | -32.3 | 0 | 0 | 0 | 111.6 | E72 L73 F74 | P70-E72 PolarHBondContact O-N 3.07Å; P70-L73 WeakPolarHBondContact O-CB 3.39Å; P70-L73 PolarHBondContact O-N 3.21Å; P70-L73 VanDerWaalsContact O-N 3.07Å; P70-F74 HydrophobicContact CB-CD2 4.27Å; P70-F74 HydrophobicContact CB-CE2 3.95Å; P70-F74 WeakPolarHBondContact O-CD2 3.36Å; P70-F74 PolarHBondContact O-N 2.87Å |
| 71 | D | 82.9 | Confident | 76.6 | Confident | 119 Ų | 119 | 106.6 Ų | 106.6 | 64% | 0.636 | 64% | 0.642 | S | S | * | * | H | α-helix | trans | -60.7 | -29.5 | 177.3 | -59.8 | -31.3 | 0 | 0 | 0 | 113.8 | K69 K75 | K69-D71 PolarHBondContact O-N 3.18Å; K69-D71 VanDerWaalsContact O-N 3.14Å; D71-K75 VanDerWaalsContact O-CG 3.26Å; D71-K75 WeakPolarHBondContact O-CG 3.45Å; D71-K75 PolarHBondContact O-N 2.89Å |
| 72 | E | 87 | Confident | 77.5 | Confident | 108 Ų | 108 | 110.1 Ų | 110.1 | 51% | 0.505 | 64% | 0.642 | S | S | . | * | H | α-helix | trans | -76.6 | -36.4 | 176.3 | -65.5 | 171.5 | -161.1 | 0 | 0 | 111.3 | P68 K69 P70 K75 | P68-E72 HydrophobicContact CB-CB 4.48Å; K69-E72 HydrophobicContact CB-CG 4.23Å; K69-E72 WeakPolarHBondContact O-CA 3.47Å; K69-E72 WeakPolarHBondContact O-CB 3.22Å; K69-E72 PolarHBondContact O-N 2.98Å; P70-E72 PolarHBondContact O-N 3.07Å; E72-K75 PolarHBondContact O-N 3.41Å |
| 73 | L | 85 | Confident | 78 | Confident | 90 Ų | 90 | 109.4 Ų | 109.4 | 47% | 0.471 | 63% | 0.627 | S | S | . | * | H | α-helix | trans | -63.4 | -46.6 | 173.5 | -65 | 172.2 | 0 | 0 | 0 | 110.7 | P68 K69 P70 K75 S76 | P68-L73 HydrophobicContact CB-CD2 4.21Å; P68-L73 HydrophobicContact CB-CG 4.32Å; P68-L73 HydrophobicContact CG-CD2 3.72Å; P68-L73 HydrophobicContact CG-CG 4.15Å; K69-L73 PolarHBondContact O-N 3.21Å; P70-L73 WeakPolarHBondContact O-CB 3.39Å; P70-L73 PolarHBondContact O-N 3.21Å; P70-L73 VanDerWaalsContact O-N 3.07Å; L73-K75 VanDerWaalsContact C-N 3.29Å; L73-K75 PolarHBondContact O-N 3.14Å; L73-S76 PolarHBondContact O-N 3.2Å; L73-S76 PolarHBondContact O-OG 2.76Å |
| 74 | F | 80.4 | Confident | 78.4 | Confident | 137 Ų | 137 | 109.8 Ų | 109.8 | 60% | 0.601 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -77.8 | -9.1 | -178.3 | -61.9 | -62.5 | 0 | 0 | 0 | 114.4 | P70 | P70-F74 HydrophobicContact CB-CD2 4.27Å; P70-F74 HydrophobicContact CB-CE2 3.95Å; P70-F74 WeakPolarHBondContact O-CD2 3.36Å; P70-F74 PolarHBondContact O-N 2.87Å |
| 75 | K | 78.8 | Confident | 78.9 | Confident | 175 Ų | 175 | 109.3 Ų | 109.3 | 76% | 0.761 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -72 | -30.8 | 169.4 | -90.2 | 172.4 | 157.8 | -177.7 | 0 | 112.9 | D71 E72 L73 | D71-K75 VanDerWaalsContact O-CG 3.26Å; D71-K75 WeakPolarHBondContact O-CG 3.45Å; D71-K75 PolarHBondContact O-N 2.89Å; E72-K75 PolarHBondContact O-N 3.41Å; L73-K75 VanDerWaalsContact C-N 3.29Å; L73-K75 PolarHBondContact O-N 3.14Å |
| 76 | S | 78.1 | Confident | 78.8 | Confident | 102 Ų | 102 | 110.9 Ų | 110.9 | 71% | 0.713 | 60% | 0.595 | S | S | * | * | H | α-helix | trans | -76.7 | -26 | 179.2 | 71 | 0 | 0 | 0 | 0 | 112.8 | L73 | L73-S76 PolarHBondContact O-N 3.2Å; L73-S76 PolarHBondContact O-OG 2.76Å |
| 77 | V | 76.4 | Confident | 78.2 | Confident | 92 Ų | 92 | 112.6 Ų | 112.6 | 56% | 0.558 | 60% | 0.596 | S | S | * | * | S | Bend | trans | -91 | 117.3 | 177.8 | -176.2 | 0 | 0 | 0 | 0 | 108.3 | K79 | V77-K79 PolarHBondContact O-N 3.18Š|
| 78 | S | 78.9 | Confident | 77.3 | Confident | 108 Ų | 108 | 109.3 Ų | 109.3 | 76% | 0.755 | 58% | 0.579 | S | S | * | * | P | Polyproline II helix | trans | -51.8 | 124.5 | 173.8 | 174 | 0 | 0 | 0 | 0 | 109.9 | ||
| 79 | K | 78.8 | Confident | 76.8 | Confident | 149 Ų | 149 | 113.7 Ų | 113.7 | 65% | 0.648 | 59% | 0.592 | S | S | * | * | P | Polyproline II helix | trans | -59 | 129.5 | 174.9 | -67.4 | -179 | 179.9 | -179.6 | 0 | 108.5 | V77 | V77-K79 PolarHBondContact O-N 3.18Š|
| 80 | P | 77.8 | Confident | 76.1 | Confident | 60 Ų | 60 | 113.9 Ų | 113.9 | 39% | 0.39 | 60% | 0.595 | S | S | . | * | P | Polyproline II helix | trans | -66.1 | 144.3 | 179.9 | 28.2 | -34.4 | 0 | 0 | 0 | 109.8 | F82 L83 | P80-F82 HydrophobicContact CB-CD1 3.72Å; P80-F82 HydrophobicContact CB-CE1 3.36Å; P80-F82 HydrophobicContact CB-CZ 4.07Å; P80-F82 HydrophobicContact CG-CD1 4.12Å; P80-F82 HydrophobicContact CG-CE1 3.49Å; P80-F82 VanDerWaalsContact CG-CE1 3.49Å; P80-F82 HydrophobicContact CG-CE2 4.42Å; P80-F82 HydrophobicContact CG-CZ 3.65Å; P80-F82 PolarHBondContact O-N 3.44Å; P80-L83 HydrophobicContact CG-CD1 3.65Å; P80-L83 PolarHBondContact O-N 3.43Å |
| 81 | S | 70.7 | Confident | 75.8 | Confident | 107 Ų | 107 | 111.3 Ų | 111.3 | 75% | 0.748 | 58% | 0.577 | S | S | * | * | G | 310 helix | trans | -58.2 | -24.8 | -169.9 | 53.7 | 0 | 0 | 0 | 0 | 114.1 | L83 Y84 | S81-L83 VanDerWaalsContact C-N 3.3Å; S81-L83 PolarHBondContact O-N 2.85Å; S81-Y84 WeakPolarHBondContact O-CB 2.92Å; S81-Y84 PolarHBondContact O-N 3.21Å; S81-Y84 VanDerWaalsContact O-N 3.08Å |
| 82 | F | 71.9 | Confident | 75.5 | Confident | 155 Ų | 155 | 109.9 Ų | 109.9 | 68% | 0.68 | 57% | 0.569 | S | S | * | * | G | 310 helix | trans | -73.2 | -16.6 | 177.3 | 68.3 | -96.3 | 0 | 0 | 0 | 114.2 | P80 | P80-F82 HydrophobicContact CB-CD1 3.72Å; P80-F82 HydrophobicContact CB-CE1 3.36Å; P80-F82 HydrophobicContact CB-CZ 4.07Å; P80-F82 HydrophobicContact CG-CD1 4.12Å; P80-F82 HydrophobicContact CG-CE1 3.49Å; P80-F82 VanDerWaalsContact CG-CE1 3.49Å; P80-F82 HydrophobicContact CG-CE2 4.42Å; P80-F82 HydrophobicContact CG-CZ 3.65Å; P80-F82 PolarHBondContact O-N 3.44Å |
| 83 | L | 72.1 | Confident | 75.1 | Confident | 63 Ų | 63 | 112.6 Ų | 112.6 | 33% | 0.33 | 58% | 0.575 | S | S | . | * | G | 310 helix | trans | -85.1 | -11 | 167.7 | -88.4 | 104.7 | 0 | 0 | 0 | 112.8 | P80 S81 N85 I91 | P80-L83 HydrophobicContact CG-CD1 3.65Å; P80-L83 PolarHBondContact O-N 3.43Å; S81-L83 VanDerWaalsContact C-N 3.3Å; S81-L83 PolarHBondContact O-N 2.85Å; L83-N85 PolarHBondContact O-N 3.3Å; L83-I91 HydrophobicContact CG-CD1 4.2Å |
| 84 | Y | 67.3 | Low | 74.8 | Confident | 137 Ų | 137 | 116.8 Ų | 116.8 | 54% | 0.537 | 59% | 0.592 | S | S | . | * | trans | -92.6 | 95.1 | 179.1 | -168.3 | -100.1 | 0 | 0 | 0 | 109.6 | S81 P86 K89 | S81-Y84 WeakPolarHBondContact O-CB 2.92Å; S81-Y84 PolarHBondContact O-N 3.21Å; S81-Y84 VanDerWaalsContact O-N 3.08Å; Y84-P86 HydrophobicContact CE1-CB 4.41Å; Y84-K89 HydrophobicContact CE2-CG 4.33Å | ||
| 85 | N | 72.5 | Confident | 74.5 | Confident | 65 Ų | 65 | 114.8 Ų | 114.8 | 35% | 0.348 | 60% | 0.595 | S | S | . | * | trans | -82.6 | 119 | 165.2 | 170.5 | 11.7 | 0 | 0 | 0 | 107.7 | L83 L87 N88 K89 | L83-N85 PolarHBondContact O-N 3.3Å; N85-L87 PolarHBondContact O-N 2.94Å; N85-L87 VanDerWaalsContact O-N 3.11Å; N85-L87 PolarHBondContact OD1-N 3.42Å; N85-N88 VanDerWaalsContact CB-O 3.22Å; N85-N88 WeakPolarHBondContact CB-O 3.44Å; N85-N88 CarbonylContact O-C 3.1Å; N85-N88 PolarHBondContact O-N 2.87Å; N85-K89 PolarHBondContact O-N 3.27Å | ||
| 86 | P | 72.4 | Confident | 74.2 | Confident | 103 Ų | 103 | 114 Ų | 114 | 67% | 0.669 | 59% | 0.587 | S | S | * | * | S | Bend | trans | -63.3 | -19.2 | -172.5 | 24.1 | -34.2 | 0 | 0 | 0 | 113.8 | Y84 | Y84-P86 HydrophobicContact CE1-CB 4.41Š|
| 87 | L | 71.1 | Confident | 74.3 | Confident | 154 Ų | 154 | 111.6 Ų | 111.6 | 81% | 0.806 | 57% | 0.573 | S | S | * | * | S | Bend | trans | -90.4 | -43.8 | 175.8 | -63.1 | 171.8 | 0 | 0 | 0 | 111.7 | N85 | N85-L87 PolarHBondContact O-N 2.94Å; N85-L87 VanDerWaalsContact O-N 3.11Å; N85-L87 PolarHBondContact OD1-N 3.42Å |
| 88 | N | 65.4 | Low | 74.2 | Confident | 92 Ų | 92 | 113.8 Ų | 113.8 | 49% | 0.492 | 59% | 0.586 | S | S | . | * | S | Bend | trans | -123.4 | 106.1 | 177.1 | -68.3 | -16.2 | 0 | 0 | 0 | 109 | N85 Q90 | N85-N88 VanDerWaalsContact CB-O 3.22Å; N85-N88 WeakPolarHBondContact CB-O 3.44Å; N85-N88 CarbonylContact O-C 3.1Å; N85-N88 PolarHBondContact O-N 2.87Å; N88-Q90 PolarHBondContact O-N 3.08Å |
| 89 | K | 73.8 | Confident | 73.9 | Confident | 157 Ų | 157 | 117 Ų | 117 | 68% | 0.683 | 59% | 0.587 | S | S | * | * | S | Bend | trans | -57.4 | -5.3 | -174.5 | -61.1 | 175 | -177.8 | 176.7 | 0 | 115 | Y84 N85 | Y84-K89 HydrophobicContact CE2-CG 4.33Å; N85-K89 PolarHBondContact O-N 3.27Å |
| 90 | Q | 73.8 | Confident | 73.8 | Confident | 139 Ų | 139 | 113.8 Ų | 113.8 | 65% | 0.65 | 59% | 0.588 | S | S | * | * | S | Bend | trans | -132.5 | 137.6 | 178.1 | -67.9 | 174.4 | -25.1 | 0 | 0 | 108.7 | N88 D92 | N88-Q90 PolarHBondContact O-N 3.08Å; Q90-D92 PolarHBondContact O-N 2.96Å |
| 91 | I | 77.3 | Confident | 73.3 | Confident | 25 Ų | 25 | 116.4 Ų | 116.4 | 13% | 0.128 | 61% | 0.605 | C | S | . | * | trans | -76 | 116.8 | 170 | -65.6 | 171.8 | 0 | 0 | 0 | 107.1 | L83 W93 R96 | L83-I91 HydrophobicContact CG-CD1 4.2Å; I91-W93 VanDerWaalsContact C-N 3.26Å; I91-W93 HydrophobicContact CB-CZ2 4.4Å; I91-W93 HydrophobicContact CD1-CZ2 4.02Å; I91-W93 HydrophobicContact CG2-CD2 3.77Å; I91-W93 HydrophobicContact CG2-CE3 4.14Å; I91-W93 HydrophobicContact CG2-CG 4.15Å; I91-W93 HydrophobicContact CG2-CH2 4.41Å; I91-W93 HydrophobicContact CG2-CZ2 4.05Å; I91-W93 HydrophobicContact CG2-CZ3 4.45Å; I91-W93 VanDerWaalsContact O-CD1 3.29Å; I91-W93 PolarHBondContact O-N 3.04Å; I91-R96 VanDerWaalsContact CG2-NH1 3.27Å | ||
| 92 | D | 76.3 | Confident | 73.1 | Confident | 89 Ų | 89 | 120.3 Ų | 120.3 | 48% | 0.476 | 61% | 0.611 | S | S | . | * | trans | -72 | 85.1 | 170.9 | -62.1 | -32.3 | 0 | 0 | 0 | 108.9 | Q90 E94 S95 R96 | Q90-D92 PolarHBondContact O-N 2.96Å; D92-E94 PolarHBondContact O-N 2.81Å; D92-S95 WeakPolarHBondContact CB-OG 3.24Å; D92-S95 PolarHBondContact O-N 2.7Å; D92-S95 PolarHBondContact O-OG 3.07Å; D92-R96 PolarHBondContact O-N 3.14Å | ||
| 93 | W | 78.8 | Confident | 72.8 | Confident | 166 Ų | 166 | 119 Ų | 119 | 63% | 0.629 | 61% | 0.608 | S | S | * | * | H | α-helix | trans | -60.5 | -25.8 | 178.9 | -69.7 | 107.6 | 0 | 0 | 0 | 112.4 | I91 R96 A97 | I91-W93 VanDerWaalsContact C-N 3.26Å; I91-W93 HydrophobicContact CB-CZ2 4.4Å; I91-W93 HydrophobicContact CD1-CZ2 4.02Å; I91-W93 HydrophobicContact CG2-CD2 3.77Å; I91-W93 HydrophobicContact CG2-CE3 4.14Å; I91-W93 HydrophobicContact CG2-CG 4.15Å; I91-W93 HydrophobicContact CG2-CH2 4.41Å; I91-W93 HydrophobicContact CG2-CZ2 4.05Å; I91-W93 HydrophobicContact CG2-CZ3 4.45Å; I91-W93 VanDerWaalsContact O-CD1 3.29Å; I91-W93 PolarHBondContact O-N 3.04Å; W93-R96 PolarHBondContact O-N 3.12Å; W93-A97 VanDerWaalsContact O-CB 3.24Å; W93-A97 WeakPolarHBondContact O-CB 3.44Å; W93-A97 PolarHBondContact O-N 2.71Å |
| 94 | E | 77.3 | Confident | 72.6 | Confident | 178 Ų | 178 | 121.3 Ų | 121.3 | 83% | 0.832 | 63% | 0.626 | S | S | * | * | H | α-helix | trans | -70.5 | -32.6 | 178 | -60.6 | -161.5 | 144.1 | 0 | 0 | 113.3 | D92 | D92-E94 PolarHBondContact O-N 2.81Å |
| 95 | S | 74.1 | Confident | 72.5 | Confident | 94 Ų | 94 | 118.7 Ų | 118.7 | 66% | 0.657 | 63% | 0.633 | S | S | * | * | H | α-helix | trans | -80.9 | -26 | 176.2 | 68.7 | 0 | 0 | 0 | 0 | 112.3 | D92 | D92-S95 WeakPolarHBondContact CB-OG 3.24Å; D92-S95 PolarHBondContact O-N 2.7Å; D92-S95 PolarHBondContact O-OG 3.07Å |
| 96 | R | 73.4 | Confident | 72.2 | Confident | 160 Ų | 160 | 122 Ų | 122 | 60% | 0.604 | 64% | 0.644 | S | S | * | * | H | α-helix | trans | -91.2 | -20.8 | -179.2 | -69 | 175 | 128.3 | -168.1 | 0.2 | 113.7 | I91 D92 W93 V98 | I91-R96 VanDerWaalsContact CG2-NH1 3.27Å; D92-R96 PolarHBondContact O-N 3.14Å; W93-R96 PolarHBondContact O-N 3.12Å; R96-V98 PolarHBondContact O-N 2.91Å |
| 97 | A | 80.4 | Confident | 72.1 | Confident | 50 Ų | 50 | 125.1 Ų | 125.1 | 41% | 0.413 | 65% | 0.65 | S | S | . | * | S | Bend | trans | -67.1 | 106.6 | 170.5 | 0 | 0 | 0 | 0 | 0 | 107.9 | W93 K99 | W93-A97 VanDerWaalsContact O-CB 3.24Å; W93-A97 WeakPolarHBondContact O-CB 3.44Å; W93-A97 PolarHBondContact O-N 2.71Å; A97-K99 PolarHBondContact O-N 2.9Å |
| 98 | V | 74.1 | Confident | 71.8 | Confident | 139 Ų | 139 | 126.4 Ų | 126.4 | 84% | 0.842 | 65% | 0.649 | S | S | * | * | trans | -56.8 | 104.9 | 168.9 | 178.7 | 0 | 0 | 0 | 0 | 106.5 | R96 A100 | R96-V98 PolarHBondContact O-N 2.91Å; V98-A100 PolarHBondContact O-N 2.87Å; V98-A100 VanDerWaalsContact O-N 3.14Å | ||
| 99 | K | 73.1 | Confident | 72 | Confident | 174 Ų | 174 | 131.6 Ų | 131.6 | 76% | 0.757 | 67% | 0.667 | S | S | * | * | P | Polyproline II helix | trans | -60.9 | 121.2 | 170.8 | -74.2 | -72.9 | 158.9 | -178.5 | 0 | 106.1 | A97 | A97-K99 PolarHBondContact O-N 2.9Š|
| 100 | A | 75.3 | Confident | 71.9 | Confident | 82 Ų | 82 | 129.7 Ų | 129.7 | 68% | 0.678 | 67% | 0.669 | S | S | * | * | P | Polyproline II helix | trans | -49.6 | 134.7 | 170.2 | 0 | 0 | 0 | 0 | 0 | 107.1 | V98 E102 | V98-A100 PolarHBondContact O-N 2.87Å; V98-A100 VanDerWaalsContact O-N 3.14Å; A100-E102 PolarHBondContact O-N 2.91Å; A100-E102 VanDerWaalsContact O-N 3.12Å |
| 101 | P | 68.7 | Low | 71.3 | Confident | 116 Ų | 116 | 133 Ų | 133 | 75% | 0.753 | 68% | 0.675 | S | S | * | * | P | Polyproline II helix | trans | -46.2 | 126.9 | 172.5 | -25.8 | 33.4 | 0 | 0 | 0 | 108.1 | E103 | P101-E103 VanDerWaalsContact C-N 3.35Å; P101-E103 PolarHBondContact O-N 2.95Å |
| 102 | E | 66.5 | Low | 70.8 | Confident | 188 Ų | 188 | 141.3 Ų | 141.3 | 88% | 0.879 | 71% | 0.711 | S | S | * | * | trans | -54.9 | 102.3 | 177.9 | -177.7 | -175.4 | 167.9 | 0 | 0 | 107.3 | A100 P104 | A100-E102 PolarHBondContact O-N 2.91Å; A100-E102 VanDerWaalsContact O-N 3.12Å; E102-P104 WeakPolarHBondContact O-CD 3.33Å | ||
| 103 | E | 66.1 | Low | 70.2 | Confident | 129 Ų | 129 | 141.4 Ų | 141.4 | 60% | 0.603 | 71% | 0.714 | S | S | * | * | trans | -61.2 | 121.4 | 176 | -69.9 | -165.9 | 144.5 | 0 | 0 | 106.1 | P101 A105 K106 | P101-E103 VanDerWaalsContact C-N 3.35Å; P101-E103 PolarHBondContact O-N 2.95Å; E103-A105 PolarHBondContact O-N 2.98Å; E103-K106 IonicContact OE1-NZ 2.88Å; E103-K106 PolarHBondContact OE1-NZ 2.83Å; E103-K106 IonicContact OE2-NZ 2.6Å; E103-K106 PolarHBondContact OE2-NZ 2.96Å | ||
| 104 | P | 67.4 | Low | 69.2 | Low | 111 Ų | 111 | 141.9 Ų | 141.9 | 72% | 0.721 | 73% | 0.73 | S | S | * | * | trans | -54.9 | 135.9 | 172.6 | 25.2 | -33.2 | 0 | 0 | 0 | 107 | E102 K106 | E102-P104 WeakPolarHBondContact O-CD 3.33Å; P104-K106 PolarHBondContact O-N 3.26Å | ||
| 105 | A | 65.6 | Low | 68 | Low | 82 Ų | 82 | 137.1 Ų | 137.1 | 68% | 0.678 | 72% | 0.72 | S | S | * | * | trans | -40.3 | 113.3 | -174.2 | 0 | 0 | 0 | 0 | 0 | 109.6 | E103 E107 | E103-A105 PolarHBondContact O-N 2.98Å; A105-E107 PolarHBondContact O-N 3.22Å | ||
| 106 | K | 65.6 | Low | 67 | Low | 134 Ų | 134 | 138.9 Ų | 138.9 | 58% | 0.583 | 73% | 0.727 | S | S | * | * | trans | -65 | 86.1 | 173.2 | -88.1 | 166.7 | -180 | 149.5 | 0 | 106.5 | E103 P104 F108 | E103-K106 IonicContact OE1-NZ 2.88Å; E103-K106 PolarHBondContact OE1-NZ 2.83Å; E103-K106 IonicContact OE2-NZ 2.6Å; E103-K106 PolarHBondContact OE2-NZ 2.96Å; P104-K106 PolarHBondContact O-N 3.26Å; K106-F108 HydrophobicContact CB-CD2 4.42Å; K106-F108 HydrophobicContact CB-CE2 4.23Å; K106-F108 WeakPolarHBondContact O-CD2 3.27Å; K106-F108 PolarHBondContact O-N 3.1Å | ||
| 107 | E | 70.9 | Confident | 66.1 | Low | 168 Ų | 168 | 136 Ų | 136 | 79% | 0.785 | 73% | 0.729 | S | S | * | * | trans | -66.3 | 90.7 | 170.9 | -65 | 175.4 | -146.7 | 0 | 0 | 106.7 | A105 K109 | A105-E107 PolarHBondContact O-N 3.22Å; E107-K109 PolarHBondContact O-N 2.8Å | ||
| 108 | F | 63.9 | Low | 64.7 | Low | 182 Ų | 182 | 140 Ų | 140 | 80% | 0.798 | 75% | 0.75 | S | S | * | * | trans | -59.8 | 102.8 | 171.8 | -84.5 | -93.4 | 0 | 0 | 0 | 108.3 | K106 V110 | K106-F108 HydrophobicContact CB-CD2 4.42Å; K106-F108 HydrophobicContact CB-CE2 4.23Å; K106-F108 WeakPolarHBondContact O-CD2 3.27Å; K106-F108 PolarHBondContact O-N 3.1Å; F108-V110 VanDerWaalsContact C-N 3.32Å; F108-V110 PolarHBondContact O-N 3.04Å | ||
| 109 | K | 69.9 | Low | 63.5 | Low | 200 Ų | 200 | 141.5 Ų | 141.5 | 87% | 0.87 | 75% | 0.748 | S | S | * | * | trans | -66.9 | 97 | 165.6 | -75.9 | -169.1 | 174.5 | 179.3 | 0 | 107.9 | E107 W111 | E107-K109 PolarHBondContact O-N 2.8Å; K109-W111 PolarHBondContact O-N 3.38Å | ||
| 110 | V | 71.2 | Confident | 62.5 | Low | 117 Ų | 117 | 139.5 Ų | 139.5 | 71% | 0.709 | 75% | 0.751 | S | S | * | * | trans | -57 | 106.2 | 167.8 | 178.7 | 0 | 0 | 0 | 0 | 107.1 | F108 K112 | F108-V110 VanDerWaalsContact C-N 3.32Å; F108-V110 PolarHBondContact O-N 3.04Å; V110-K112 PolarHBondContact O-N 2.94Å | ||
| 111 | W | 62.2 | Low | 60.7 | Low | 208 Ų | 208 | 147 Ų | 147 | 79% | 0.788 | 76% | 0.763 | S | S | * | * | trans | -44.9 | 104.7 | 169.4 | 61.7 | -36 | 0 | 0 | 0 | 110.9 | K109 T113 | K109-W111 PolarHBondContact O-N 3.38Å; W111-T113 HydrophobicContact CE3-CG2 4.47Å; W111-T113 PolarHBondContact O-N 2.74Å | ||
| 112 | K | 66.3 | Low | 59.1 | Low | 201 Ų | 201 | 145.6 Ų | 145.6 | 87% | 0.874 | 76% | 0.762 | S | S | * | * | trans | -84.7 | 88 | 169.4 | -78.5 | 180 | 173 | 175.6 | 0 | 108 | V110 | V110-K112 PolarHBondContact O-N 2.94Š| ||
| 113 | T | 62.8 | Low | 58.1 | Low | 90 Ų | 90 | 141.5 Ų | 141.5 | 55% | 0.552 | 76% | 0.76 | S | S | * | * | trans | -108.2 | 100.1 | 163.4 | 55.9 | 0 | 0 | 0 | 0 | 109 | W111 A115 | W111-T113 HydrophobicContact CE3-CG2 4.47Å; W111-T113 PolarHBondContact O-N 2.74Å; T113-A115 PolarHBondContact O-N 3.05Å | ||
| 114 | N | 58.7 | Low | 57 | Low | 177 Ų | 177 | 144.2 Ų | 144.2 | 95% | 0.947 | 77% | 0.773 | S | S | * | * | trans | -68.2 | 81.1 | 153.2 | -73.3 | -52.7 | 0 | 0 | 0 | 107.2 | ||||
| 115 | A | 51.7 | Low | 56.1 | Low | 77 Ų | 77 | 142.9 Ų | 142.9 | 64% | 0.636 | 77% | 0.771 | S | S | * | * | trans | -133.8 | 117.7 | 168.5 | 0 | 0 | 0 | 0 | 0 | 107.5 | T113 | T113-A115 PolarHBondContact O-N 3.05Š| ||
| 116 | V | 53.2 | Low | 55.2 | Low | 132 Ų | 132 | 148.2 Ų | 148.2 | 80% | 0.8 | 78% | 0.782 | S | S | * | * | trans | -41.7 | 137.3 | 176.8 | 176.5 | 0 | 0 | 0 | 0 | 111.1 | ||||
| 117 | P | 54 | Low | 54.3 | Low | 100 Ų | 100 | 151.3 Ų | 151.3 | 65% | 0.649 | 80% | 0.796 | S | S | * | * | trans | -66.7 | 130.6 | 176.2 | 26.4 | -32.4 | 0 | 0 | 0 | 110.3 | Q119 | P117-Q119 PolarHBondContact O-N 3.15Š| ||
| 118 | P | 50.8 | Low | 53.7 | Low | 132 Ų | 132 | 148.4 Ų | 148.4 | 86% | 0.857 | 79% | 0.791 | S | S | * | * | trans | -69.4 | 106.6 | 169.1 | 27.1 | -30.8 | 0 | 0 | 0 | 108.8 | ||||
| 119 | Q | 49.9 | Very low | 52.8 | Low | 171 Ų | 171 | 148.8 Ų | 148.8 | 80% | 0.799 | 79% | 0.793 | S | S | * | * | trans | -76.6 | 136 | 160.5 | -69.4 | -155.1 | -34.5 | 0 | 0 | 109.2 | P117 | P117-Q119 PolarHBondContact O-N 3.15Š| ||
| 120 | T | 51.9 | Low | 51.9 | Low | 133 Ų | 133 | 149.2 Ų | 149.2 | 82% | 0.816 | 79% | 0.794 | S | S | * | * | trans | 68 | 105.3 | 170.6 | 66 | 0 | 0 | 0 | 0 | 117.2 | ||||
| 121 | Y | 37.5 | Very low | 50.8 | Low | 238 Ų | 238 | 147.7 Ų | 147.7 | 93% | 0.933 | 80% | 0.803 | S | S | * | * | trans | -138.8 | 137.6 | 138.2 | -137.5 | -95 | 0 | 0 | 0 | 109.9 | ||||
| 122 | A | 35.6 | Very low | 50.4 | Low | 87 Ų | 87 | 141.8 Ų | 141.8 | 72% | 0.719 | 80% | 0.798 | S | S | * | * | trans | -65.4 | 154.4 | -163.1 | 0 | 0 | 0 | 0 | 0 | 114.7 | E124 | A122-E124 PolarHBondContact O-N 3.48Š| ||
| 123 | A | 45.5 | Very low | 49.9 | Very low | 103 Ų | 103 | 137.5 Ų | 137.5 | 85% | 0.851 | 79% | 0.791 | S | S | * | * | trans | -73.8 | 109.7 | 156 | 0 | 0 | 0 | 0 | 0 | 108.9 | ||||
| 124 | E | 43.1 | Very low | 49.8 | Very low | 185 Ų | 185 | 139.7 Ų | 139.7 | 86% | 0.864 | 81% | 0.807 | S | S | * | * | trans | -168.2 | 127.1 | 145 | -150.8 | 169.5 | 171.2 | 0 | 0 | 112.2 | A122 | A122-E124 PolarHBondContact O-N 3.48Š| ||
| 125 | A | 48.5 | Very low | 49.9 | Very low | 83 Ų | 83 | 134.6 Ų | 134.6 | 69% | 0.686 | 80% | 0.796 | S | S | * | * | trans | 42.6 | 119.7 | 149.3 | 0 | 0 | 0 | 0 | 0 | 123.6 | ||||
| 126 | E | 45.9 | Very low | 50.5 | Low | 195 Ų | 195 | 136 Ų | 136 | 91% | 0.911 | 79% | 0.791 | S | S | * | * | trans | 78.2 | 146.2 | 134.5 | -60.1 | -162.8 | 177.2 | 0 | 0 | 122.9 | ||||
| 127 | K | 47.7 | Very low | 51.4 | Low | 199 Ų | 199 | 134.5 Ų | 134.5 | 87% | 0.865 | 78% | 0.778 | S | S | * | * | trans | -78.8 | -167.2 | -161.2 | -45.7 | -172.4 | 175.9 | 177.9 | 0 | 113 | ||||
| 128 | P | 58.2 | Low | 52.6 | Low | 107 Ų | 107 | 135.3 Ų | 135.3 | 70% | 0.695 | 78% | 0.775 | S | S | * | * | cis | -134.3 | 173.6 | -13 | 32.8 | -12.4 | 0 | 0 | 0 | 114.1 | ||||
| 129 | K | 44.4 | Very low | 53.4 | Low | 190 Ų | 190 | 131.9 Ų | 131.9 | 83% | 0.826 | 76% | 0.758 | S | S | * | * | 177.2 | 129.8 | 125.4 | -77 | -123.2 | 175.2 | 94.5 | 0 | 113 | |||||
| 130 | K | 49.8 | Very low | 54.2 | Low | 208 Ų | 208 | 127.1 Ų | 127.1 | 90% | 0.904 | 74% | 0.737 | S | S | * | * | trans | 58.6 | 103.1 | 151.1 | -89.6 | 177.8 | 167.7 | -179.3 | 0 | 119.2 | ||||
| 131 | G | 48.6 | Very low | 55.2 | Low | 86 Ų | 86 | 126.5 Ų | 126.5 | 89% | 0.887 | 72% | 0.723 | S | S | * | * | S | Bend | trans | -172.7 | -7.1 | 165.2 | 0 | 0 | 0 | 0 | 0 | 117.8 | ||
| 132 | A | 53.3 | Low | 56.7 | Low | 83 Ų | 83 | 123.7 Ų | 123.7 | 69% | 0.686 | 71% | 0.711 | S | S | * | * | S | Bend | trans | -142.7 | 127.6 | 170.2 | 0 | 0 | 0 | 0 | 0 | 109.4 | ||
| 133 | P | 57.3 | Low | 58.1 | Low | 111 Ų | 111 | 122.4 Ų | 122.4 | 72% | 0.721 | 70% | 0.697 | S | S | * | * | trans | -59.2 | 125.6 | 169.3 | 24.3 | -30 | 0 | 0 | 0 | 108 | G135 | P133-G135 PolarHBondContact O-N 2.81Š| ||
| 134 | P | 59.8 | Low | 59 | Low | 136 Ų | 136 | 120.8 Ų | 120.8 | 88% | 0.883 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -70.6 | 118.9 | -179.2 | 27.4 | -30.4 | 0 | 0 | 0 | 108.7 | ||
| 135 | G | 60.2 | Low | 60.1 | Low | 71 Ų | 71 | 117.1 Ų | 117.1 | 73% | 0.732 | 66% | 0.659 | S | S | * | * | T | Hydrogen-bonded Turn | trans | 128.4 | -10 | 165.1 | 0 | 0 | 0 | 0 | 0 | 116.7 | P133 | P133-G135 PolarHBondContact O-N 2.81Š|
| 136 | M | 64.6 | Low | 60.6 | Low | 106 Ų | 106 | 122.3 Ų | 122.3 | 52% | 0.522 | 66% | 0.662 | S | S | . | * | trans | -101.2 | 94.3 | 176.4 | -153.6 | 76.6 | 81.8 | 0 | 0 | 110 | I140 K141 | M136-I140 HydrophobicContact CG-CB 4.21Å; M136-I140 HydrophobicContact CG-CG2 4.07Å; M136-I140 HydrophobicContact SD-CB 4.08Å; M136-I140 HydrophobicContact SD-CG2 3.38Å; M136-I140 WeakPolarHBondContact SD-CG2 3.49Å; M136-K141 HydrophobicContact CG-CG 3.94Å | ||
| 137 | D | 73 | Confident | 61.3 | Low | 100 Ų | 100 | 120.1 Ų | 120.1 | 54% | 0.535 | 65% | 0.652 | S | S | . | * | trans | -52.9 | 142.7 | 173.4 | -172 | 14.5 | 0 | 0 | 0 | 109.7 | A139 I140 K141 | D137-A139 PolarHBondContact O-N 2.99Å; D137-A139 WeakPolarHBondContact OD2-CB 3.49Å; D137-I140 HydrophobicContact CB-CB 4.47Å; D137-I140 HydrophobicContact CB-CD1 3.8Å; D137-I140 HydrophobicContact CB-CG1 3.94Å; D137-I140 WeakPolarHBondContact O-CA 3.46Å; D137-I140 WeakPolarHBondContact O-CB 3.48Å; D137-I140 PolarHBondContact O-N 2.94Å; D137-K141 PolarHBondContact O-N 2.76Å | ||
| 138 | M | 79.3 | Confident | 62 | Low | 117 Ų | 117 | 117.5 Ų | 117.5 | 58% | 0.576 | 65% | 0.647 | S | S | * | * | H | α-helix | trans | -58.8 | -34.1 | 178.3 | -78.9 | -163.8 | 59.2 | 0 | 0 | 110.1 | I140 K141 W142 | M138-I140 VanDerWaalsContact C-N 3.27Å; M138-I140 PolarHBondContact O-N 3.09Å; M138-K141 WeakPolarHBondContact O-CB 3.35Å; M138-K141 PolarHBondContact O-N 2.97Å; M138-W142 PolarHBondContact O-N 3.11Å |
| 139 | A | 67.5 | Low | 61.8 | Low | 61 Ų | 61 | 117.2 Ų | 117.2 | 50% | 0.504 | 64% | 0.64 | S | S | . | * | H | α-helix | trans | -57.8 | -39.1 | 171.6 | 0 | 0 | 0 | 0 | 0 | 112.8 | D137 W142 S143 | D137-A139 PolarHBondContact O-N 2.99Å; D137-A139 WeakPolarHBondContact OD2-CB 3.49Å; A139-W142 PolarHBondContact O-N 2.91Å; A139-S143 WeakPolarHBondContact O-CB 3.35Å; A139-S143 PolarHBondContact O-N 2.88Å |
| 140 | I | 65.7 | Low | 62.2 | Low | 70 Ų | 70 | 111.4 Ų | 111.4 | 36% | 0.359 | 63% | 0.634 | S | S | . | * | H | α-helix | trans | -68.4 | -36.7 | 175.6 | -58 | 167 | 0 | 0 | 0 | 110.5 | M136 D137 M138 W142 S143 N144 | M136-I140 HydrophobicContact CG-CB 4.21Å; M136-I140 HydrophobicContact CG-CG2 4.07Å; M136-I140 HydrophobicContact SD-CB 4.08Å; M136-I140 HydrophobicContact SD-CG2 3.38Å; M136-I140 WeakPolarHBondContact SD-CG2 3.49Å; D137-I140 HydrophobicContact CB-CB 4.47Å; D137-I140 HydrophobicContact CB-CD1 3.8Å; D137-I140 HydrophobicContact CB-CG1 3.94Å; D137-I140 WeakPolarHBondContact O-CA 3.46Å; D137-I140 WeakPolarHBondContact O-CB 3.48Å; D137-I140 PolarHBondContact O-N 2.94Å; M138-I140 VanDerWaalsContact C-N 3.27Å; M138-I140 PolarHBondContact O-N 3.09Å; I140-W142 VanDerWaalsContact C-N 3.31Å; I140-W142 PolarHBondContact O-N 2.6Å; I140-S143 VanDerWaalsContact O-CB 3.32Å; I140-S143 WeakPolarHBondContact O-CB 3.47Å; I140-S143 PolarHBondContact O-N 2.62Å; I140-N144 VanDerWaalsContact O-CG 3.23Å; I140-N144 PolarHBondContact O-N 3.44Å; I140-N144 PolarHBondContact O-OD1 3.42Å |
| 141 | K | 74.6 | Confident | 62.5 | Low | 120 Ų | 120 | 109.8 Ų | 109.8 | 52% | 0.522 | 63% | 0.63 | S | S | . | * | H | α-helix | trans | -64.2 | -34.2 | 172.2 | -67.8 | 176.6 | 59.8 | -178.4 | 0 | 113.1 | M136 D137 M138 | M136-K141 HydrophobicContact CG-CG 3.94Å; D137-K141 PolarHBondContact O-N 2.76Å; M138-K141 WeakPolarHBondContact O-CB 3.35Å; M138-K141 PolarHBondContact O-N 2.97Å |
| 142 | W | 67.9 | Low | 63 | Low | 179 Ų | 179 | 112.4 Ų | 112.4 | 68% | 0.678 | 62% | 0.623 | S | S | * | * | H | α-helix | trans | -79 | -26 | 176.5 | -68.2 | 49.2 | 0 | 0 | 0 | 111.5 | M138 A139 I140 | M138-W142 PolarHBondContact O-N 3.11Å; A139-W142 PolarHBondContact O-N 2.91Å; I140-W142 VanDerWaalsContact C-N 3.31Å; I140-W142 PolarHBondContact O-N 2.6Å |
| 143 | S | 64.6 | Low | 63.2 | Low | 60 Ų | 60 | 111.1 Ų | 111.1 | 42% | 0.42 | 61% | 0.613 | S | S | . | * | H | α-helix | trans | -66 | -44.4 | 169.2 | -167.8 | 0 | 0 | 0 | 0 | 111.5 | A139 I140 I145 Y146 | A139-S143 WeakPolarHBondContact O-CB 3.35Å; A139-S143 PolarHBondContact O-N 2.88Å; I140-S143 VanDerWaalsContact O-CB 3.32Å; I140-S143 WeakPolarHBondContact O-CB 3.47Å; I140-S143 PolarHBondContact O-N 2.62Å; S143-I145 VanDerWaalsContact C-N 3.3Å; S143-I145 PolarHBondContact O-N 3.2Å; S143-Y146 PolarHBondContact O-N 3.36Å |
| 144 | N | 65.9 | Low | 63.1 | Low | 70 Ų | 70 | 111.8 Ų | 111.8 | 37% | 0.374 | 62% | 0.617 | S | S | . | * | H | α-helix | trans | -73.5 | -14.9 | -173.8 | -68.3 | 5.1 | 0 | 0 | 0 | 114.7 | I140 Y146 E147 | I140-N144 VanDerWaalsContact O-CG 3.23Å; I140-N144 PolarHBondContact O-N 3.44Å; I140-N144 PolarHBondContact O-OD1 3.42Å; N144-Y146 PolarHBondContact O-N 2.94Å; N144-Y146 VanDerWaalsContact O-N 3.13Å; N144-E147 PolarHBondContact O-N 2.93Å |
| 145 | I | 65.4 | Low | 63.2 | Low | 108 Ų | 108 | 112.8 Ų | 112.8 | 55% | 0.554 | 61% | 0.61 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62.5 | -17.5 | 175.3 | -73.5 | 167 | 0 | 0 | 0 | 112 | S143 | S143-I145 VanDerWaalsContact C-N 3.3Å; S143-I145 PolarHBondContact O-N 3.2Å |
| 146 | Y | 59.1 | Low | 63.1 | Low | 192 Ų | 192 | 114.4 Ų | 114.4 | 75% | 0.753 | 61% | 0.608 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -118.7 | -0 | -177.6 | -71.8 | -82.6 | 0 | 0 | 0 | 114.5 | S143 N144 | S143-Y146 PolarHBondContact O-N 3.36Å; N144-Y146 PolarHBondContact O-N 2.94Å; N144-Y146 VanDerWaalsContact O-N 3.13Å |
| 147 | E | 61.3 | Low | 62.1 | Low | 148 Ų | 148 | 116.2 Ų | 116.2 | 69% | 0.692 | 62% | 0.615 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.5 | -16.7 | 177.2 | -73.5 | -168.2 | 163.9 | 0 | 0 | 113.6 | N144 | N144-E147 PolarHBondContact O-N 2.93Š|
| 148 | D | 60.7 | Low | 61.2 | Low | 144 Ų | 144 | 118.4 Ų | 118.4 | 77% | 0.77 | 63% | 0.632 | S | S | * | * | S | Bend | trans | -108.4 | 20 | -177.1 | -160.2 | 28.8 | 0 | 0 | 0 | 114.5 | ||
| 149 | N | 55.4 | Low | 60.1 | Low | 101 Ų | 101 | 114.1 Ų | 114.1 | 54% | 0.54 | 62% | 0.618 | S | S | . | * | trans | -112 | 36.8 | 172.1 | -69.7 | -21.2 | 0 | 0 | 0 | 111.9 | E151 | N149-E151 PolarHBondContact O-N 3.43Š| ||
| 150 | G | 52.8 | Low | 59.6 | Low | 68 Ų | 68 | 118.8 Ų | 118.8 | 70% | 0.701 | 63% | 0.634 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -64.2 | -14.2 | 166.6 | 0 | 0 | 0 | 0 | 0 | 113.6 | ||
| 151 | E | 55.6 | Low | 59 | Low | 174 Ų | 174 | 118.3 Ų | 118.3 | 81% | 0.813 | 64% | 0.64 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -92.5 | -19.1 | -178.7 | -159.5 | 67.4 | -139.9 | 0 | 0 | 113.8 | N149 | N149-E151 PolarHBondContact O-N 3.43Š|
| 152 | D | 59.2 | Low | 58.3 | Low | 141 Ų | 141 | 117.9 Ų | 117.9 | 75% | 0.754 | 65% | 0.648 | S | S | * | * | S | Bend | trans | -97.6 | 9.1 | 176.6 | -166.5 | 46.4 | 0 | 0 | 0 | 112.4 | ||
| 153 | A | 56.7 | Low | 57.8 | Low | 57 Ų | 57 | 118 Ų | 118 | 47% | 0.471 | 65% | 0.653 | S | S | . | * | S | Bend | trans | -68.5 | 129 | 166.4 | 0 | 0 | 0 | 0 | 0 | 107.9 | Q155 | A153-Q155 PolarHBondContact O-N 2.81Š|
| 154 | P | 56.3 | Low | 57.2 | Low | 124 Ų | 124 | 121.9 Ų | 121.9 | 81% | 0.805 | 67% | 0.669 | S | S | * | * | trans | -56 | 116.8 | 174.5 | 23.1 | -32.1 | 0 | 0 | 0 | 108 | ||||
| 155 | Q | 61 | Low | 56.3 | Low | 157 Ų | 157 | 124.5 Ų | 124.5 | 73% | 0.734 | 69% | 0.689 | S | S | * | * | trans | -44.6 | 128.8 | 172.4 | -77.4 | -86.1 | -29.2 | 0 | 0 | 107.6 | A153 H157 | A153-Q155 PolarHBondContact O-N 2.81Å; Q155-H157 PolarHBondContact O-N 3.23Å | ||
| 156 | P | 58.6 | Low | 55.4 | Low | 106 Ų | 106 | 125.9 Ų | 125.9 | 69% | 0.688 | 70% | 0.703 | S | S | * | * | trans | -58.1 | 108 | 175 | 25.1 | -32.2 | 0 | 0 | 0 | 106.7 | T158 | P156-T158 PolarHBondContact O-N 2.89Š| ||
| 157 | H | 43.2 | Very low | 54.9 | Low | 143 Ų | 143 | 125.5 Ų | 125.5 | 66% | 0.662 | 71% | 0.708 | S | S | * | * | trans | -55.7 | 108.7 | -177 | 177.5 | 19.9 | 0 | 0 | 0 | 108.8 | Q155 G159 | Q155-H157 PolarHBondContact O-N 3.23Å; H157-G159 WeakPolarHBondContact CE1-CA 3.39Å; H157-G159 PolarHBondContact CE1-N 2.92Å; H157-G159 PolarHBondContact ND1-N 3.46Å; H157-G159 VanDerWaalsContact ND1-N 3.15Å; H157-G159 PolarHBondContact O-N 3.15Å; H157-G159 VanDerWaalsContact O-N 3.11Å | ||
| 158 | T | 55.4 | Low | 54.1 | Low | 146 Ų | 146 | 127.5 Ų | 127.5 | 90% | 0.896 | 72% | 0.717 | S | S | * | * | trans | -80.1 | 30.2 | 175.2 | 51.5 | 0 | 0 | 0 | 0 | 112 | P156 | P156-T158 PolarHBondContact O-N 2.89Š| ||
| 159 | G | 56.3 | Low | 53.2 | Low | 27 Ų | 27 | 129.7 Ų | 129.7 | 28% | 0.278 | 72% | 0.723 | S | S | . | * | S | Bend | trans | -123 | 139.3 | 174.9 | 0 | 0 | 0 | 0 | 0 | 109 | H157 A161 | H157-G159 WeakPolarHBondContact CE1-CA 3.39Å; H157-G159 PolarHBondContact CE1-N 2.92Å; H157-G159 PolarHBondContact ND1-N 3.46Å; H157-G159 VanDerWaalsContact ND1-N 3.15Å; H157-G159 PolarHBondContact O-N 3.15Å; H157-G159 VanDerWaalsContact O-N 3.11Å; G159-A161 VanDerWaalsContact C-N 3.27Å; G159-A161 PolarHBondContact O-N 2.93Å |
| 160 | N | 56.3 | Low | 52.4 | Low | 160 Ų | 160 | 130.3 Ų | 130.3 | 86% | 0.856 | 73% | 0.733 | S | S | * | * | trans | -60.5 | 90.3 | 179.2 | -60.5 | -8.9 | 0 | 0 | 0 | 108.7 | V162 | N160-V162 PolarHBondContact O-N 2.95Š| ||
| 161 | A | 53.5 | Low | 51.6 | Low | 59 Ų | 59 | 132.2 Ų | 132.2 | 49% | 0.488 | 74% | 0.735 | S | S | . | * | trans | -65.1 | 103 | 169.5 | 0 | 0 | 0 | 0 | 0 | 106.7 | G159 F163 | G159-A161 VanDerWaalsContact C-N 3.27Å; G159-A161 PolarHBondContact O-N 2.93Å; A161-F163 HydrophobicContact CB-CD2 4.17Å; A161-F163 HydrophobicContact CB-CE2 4.24Å; A161-F163 PolarHBondContact O-N 3.32Å | ||
| 162 | V | 58.9 | Low | 50.8 | Low | 111 Ų | 111 | 131.6 Ų | 131.6 | 67% | 0.673 | 74% | 0.737 | S | S | * | * | trans | -66.9 | 81.3 | 174.4 | -179.5 | 0 | 0 | 0 | 0 | 107.5 | N160 L164 | N160-V162 PolarHBondContact O-N 2.95Å; V162-L164 VanDerWaalsContact CG1-O 3.27Å; V162-L164 WeakPolarHBondContact CG1-O 3.44Å; V162-L164 PolarHBondContact O-N 3.34Å | ||
| 163 | F | 57.4 | Low | 49.7 | Very low | 183 Ų | 183 | 130.4 Ų | 130.4 | 80% | 0.803 | 74% | 0.74 | S | S | * | * | trans | -73 | 103.1 | 159.8 | -85.9 | -89.8 | 0 | 0 | 0 | 106.2 | A161 | A161-F163 HydrophobicContact CB-CD2 4.17Å; A161-F163 HydrophobicContact CB-CE2 4.24Å; A161-F163 PolarHBondContact O-N 3.32Å | ||
| 164 | L | 52.7 | Low | 49.1 | Very low | 141 Ų | 141 | 134.3 Ų | 134.3 | 74% | 0.738 | 75% | 0.753 | S | S | * | * | S | Bend | trans | 98.6 | 140.9 | 170.3 | -50.6 | 171.7 | 0 | 0 | 0 | 115.8 | V162 | V162-L164 VanDerWaalsContact CG1-O 3.27Å; V162-L164 WeakPolarHBondContact CG1-O 3.44Å; V162-L164 PolarHBondContact O-N 3.34Å |
| 165 | P | 46 | Very low | 48.1 | Very low | 124 Ų | 124 | 137.1 Ų | 137.1 | 81% | 0.805 | 76% | 0.755 | S | S | * | * | trans | -55.1 | 137.9 | 169.1 | -24.7 | 34.5 | 0 | 0 | 0 | 112.6 | E167 | P165-E167 PolarHBondContact O-N 2.93Å; P165-E167 VanDerWaalsContact O-N 3.1Å | ||
| 166 | T | 46.3 | Very low | 47.3 | Very low | 137 Ų | 137 | 137.3 Ų | 137.3 | 84% | 0.84 | 76% | 0.762 | S | S | * | * | S | Bend | trans | -72.7 | 79.8 | -178.8 | 44.4 | 0 | 0 | 0 | 0 | 113 | ||
| 167 | E | 48.8 | Very low | 46.2 | Very low | 185 Ų | 185 | 135.6 Ų | 135.6 | 86% | 0.864 | 76% | 0.763 | S | S | * | * | trans | -142 | 130.7 | 161.7 | -149.8 | 171.7 | -168.4 | 0 | 0 | 109.4 | P165 | P165-E167 PolarHBondContact O-N 2.93Å; P165-E167 VanDerWaalsContact O-N 3.1Å | ||
| 168 | E | 45.7 | Very low | 46.2 | Very low | 189 Ų | 189 | 136.5 Ų | 136.5 | 88% | 0.883 | 77% | 0.773 | S | S | * | * | trans | 83.7 | 73.1 | -172.3 | -61.4 | -165.1 | 133.8 | 0 | 0 | 117.4 | ||||
| 169 | Q | 41.7 | Very low | 45.8 | Very low | 190 Ų | 190 | 139.3 Ų | 139.3 | 89% | 0.888 | 77% | 0.772 | S | S | * | * | trans | -78.1 | 144.3 | 132.8 | -87.3 | -158.4 | -58.5 | 0 | 0 | 108.7 | ||||
| 170 | P | 38.9 | Very low | 44.8 | Very low | 115 Ų | 115 | 142.2 Ų | 142.2 | 75% | 0.747 | 79% | 0.794 | S | S | * | * | -135.4 | 136.9 | 120.4 | 34.9 | -23.9 | 0 | 0 | 0 | 114.3 | |||||
| 171 | S | 36 | Very low | 43.8 | Very low | 107 Ų | 107 | 139.2 Ų | 139.2 | 75% | 0.748 | 79% | 0.786 | S | S | * | * | trans | 47 | 114.5 | 143.6 | -65 | 0 | 0 | 0 | 0 | 121.2 | ||||
| 172 | D | 37 | Very low | 43.5 | Very low | 161 Ų | 161 | 141.2 Ų | 141.2 | 86% | 0.861 | 80% | 0.802 | S | S | * | * | trans | -24 | 123.6 | 138.8 | -116.2 | -61.1 | 0 | 0 | 0 | 114.1 | ||||
| 173 | S | 37.1 | Very low | 43.1 | Very low | 117 Ų | 117 | 144.6 Ų | 144.6 | 82% | 0.818 | 81% | 0.808 | S | S | * | * | trans | -144.6 | 102.7 | 154.9 | -165.7 | 0 | 0 | 0 | 0 | 108 | ||||
| 174 | D | 43.6 | Very low | 43 | Very low | 138 Ų | 138 | 145.6 Ų | 145.6 | 74% | 0.738 | 81% | 0.812 | S | S | * | * | trans | -60.2 | 119.7 | 168.6 | -176.1 | 33.7 | 0 | 0 | 0 | 110.7 | ||||
| 175 | E | 35.8 | Very low | 43.2 | Very low | 183 Ų | 183 | 150.8 Ų | 150.8 | 86% | 0.855 | 82% | 0.821 | S | S | * | * | trans | -163.8 | 118 | 151.2 | -129.6 | -177.2 | 132.8 | 0 | 0 | 110.5 | G177 | E175-G177 PolarHBondContact O-N 3.27Š| ||
| 176 | D | 44.5 | Very low | 43.9 | Very low | 162 Ų | 162 | 155.8 Ų | 155.8 | 87% | 0.866 | 82% | 0.824 | S | S | * | * | trans | -56.6 | 127.9 | 168.6 | -85.9 | -66.1 | 0 | 0 | 0 | 111.4 | ||||
| 177 | G | 34.5 | Very low | 44.7 | Very low | 69 Ų | 69 | 155.8 Ų | 155.8 | 71% | 0.711 | 82% | 0.824 | S | S | * | * | trans | -168.8 | 99.5 | 177 | 0 | 0 | 0 | 0 | 0 | 111.8 | E175 | E175-G177 PolarHBondContact O-N 3.27Š| ||
| 178 | D | 43.7 | Very low | 45.6 | Very low | 162 Ų | 162 | 150.4 Ų | 150.4 | 87% | 0.866 | 80% | 0.799 | S | S | * | * | trans | -43 | 146.2 | 168.5 | -84.2 | -59.1 | 0 | 0 | 0 | 113.2 | ||||
| 179 | K | 46.2 | Very low | 47 | Very low | 205 Ų | 205 | 144.7 Ų | 144.7 | 89% | 0.891 | 78% | 0.779 | S | S | * | * | trans | 91 | 94 | 171.7 | -51.8 | 175.4 | -173.3 | 178.9 | 0 | 115.2 | ||||
| 180 | A | 35.9 | Very low | 48.3 | Very low | 89 Ų | 89 | 143.2 Ų | 143.2 | 74% | 0.736 | 77% | 0.77 | S | S | * | * | trans | -159 | 122.9 | 144.4 | 0 | 0 | 0 | 0 | 0 | 113.9 | ||||
| 181 | S | 36.3 | Very low | 50.2 | Low | 97 Ų | 97 | 143.9 Ų | 143.9 | 68% | 0.678 | 76% | 0.764 | S | S | * | * | 81.8 | 116.8 | 124.8 | 77.7 | 0 | 0 | 0 | 0 | 119.1 | K183 | S181-K183 PolarHBondContact O-N 2.94Š| |||
| 182 | A | 46.8 | Very low | 52.2 | Low | 101 Ų | 101 | 143.4 Ų | 143.4 | 84% | 0.835 | 75% | 0.75 | S | S | * | * | S | Bend | trans | -45.1 | 102.6 | 143.8 | 0 | 0 | 0 | 0 | 0 | 110.1 | ||
| 183 | K | 50.1 | Low | 54.3 | Low | 181 Ų | 181 | 142 Ų | 142 | 79% | 0.787 | 74% | 0.736 | S | S | * | * | trans | 177.9 | 88.9 | 161.2 | -97.9 | 152.4 | -174.6 | -175.2 | 0 | 109.1 | S181 | S181-K183 PolarHBondContact O-N 2.94Š| ||
| 184 | K | 55.1 | Low | 56.4 | Low | 205 Ų | 205 | 140 Ų | 140 | 89% | 0.891 | 71% | 0.713 | S | S | * | * | trans | 174.8 | 89.8 | 148.8 | -92.8 | 155.3 | -168.2 | -175.2 | 0 | 104.2 | R186 | K184-R186 PolarHBondContact O-N 3.4Š| ||
| 185 | R | 57.8 | Low | 58.5 | Low | 249 Ų | 249 | 138.7 Ų | 138.7 | 94% | 0.94 | 70% | 0.701 | S | S | * | * | trans | -63.9 | 86.7 | 166.2 | -79.7 | -172.1 | -59 | 156.5 | 4.1 | 106.2 | V187 | R185-V187 PolarHBondContact O-N 3.23Š| ||
| 186 | R | 60.9 | Low | 60.7 | Low | 229 Ų | 229 | 135.8 Ų | 135.8 | 86% | 0.864 | 68% | 0.682 | S | S | * | * | trans | -57.2 | 112.3 | 166.8 | -167 | 169.2 | -175.7 | 159.1 | 0.2 | 104.7 | K184 E188 | K184-R186 PolarHBondContact O-N 3.4Å; R186-E188 PolarHBondContact O-N 2.86Å | ||
| 187 | V | 61.5 | Low | 62.6 | Low | 138 Ų | 138 | 135.4 Ų | 135.4 | 84% | 0.836 | 67% | 0.673 | S | S | * | * | trans | -58.2 | 111.6 | 174.8 | 176.1 | 0 | 0 | 0 | 0 | 105.4 | R185 S189 | R185-V187 PolarHBondContact O-N 3.23Å; V187-S189 PolarHBondContact O-N 3.37Å | ||
| 188 | E | 69 | Low | 64.9 | Low | 72 Ų | 72 | 138.5 Ų | 138.5 | 34% | 0.336 | 66% | 0.663 | S | S | . | * | trans | -62.5 | 136 | 179.6 | -74 | 152.4 | 176.8 | 0 | 0 | 108.7 | R186 Q192 R196 | R186-E188 PolarHBondContact O-N 2.86Å; E188-Q192 HydrophobicContact CB-CB 4.23Å; E188-Q192 HydrophobicContact CB-CG 4.23Å; E188-Q192 HydrophobicContact CG-CG 4.27Å; E188-R196 IonicContact OE1-CZ 3.16Å; E188-R196 IonicContact OE1-NH1 2.83Å; E188-R196 PolarHBondContact OE1-NH1 3.49Å; E188-R196 IonicContact OE1-NH2 2.62Å; E188-R196 PolarHBondContact OE1-NH2 3.13Å; E188-R196 IonicContact OE2-CZ 3.33Å; E188-R196 IonicContact OE2-NH1 2.7Å; E188-R196 PolarHBondContact OE2-NH1 2.92Å; E188-R196 IonicContact OE2-NH2 3.5Å | ||
| 189 | S | 75.1 | Confident | 66.5 | Low | 68 Ų | 68 | 134 Ų | 134 | 48% | 0.476 | 64% | 0.639 | S | S | . | * | trans | -58.8 | 151.6 | 177.1 | 63.8 | 0 | 0 | 0 | 0 | 109.7 | V187 Q191 Q192 K193 | V187-S189 PolarHBondContact O-N 3.37Å; S189-Q191 PolarHBondContact O-N 3.29Å; S189-Q191 VanDerWaalsContact O-N 3.15Å; S189-Q192 WeakPolarHBondContact O-CA 3.47Å; S189-Q192 WeakPolarHBondContact O-CB 3.49Å; S189-Q192 PolarHBondContact O-N 2.94Å; S189-Q192 WeakPolarHBondContact OG-CB 3.43Å; S189-Q192 PolarHBondContact OG-N 2.95Å; S189-K193 PolarHBondContact O-N 3.24Å | ||
| 190 | F | 68.1 | Low | 67.8 | Low | 159 Ų | 159 | 129.6 Ų | 129.6 | 70% | 0.697 | 63% | 0.625 | S | S | * | * | H | α-helix | trans | -50.4 | -41.7 | 178.9 | 179.6 | -96 | 0 | 0 | 0 | 111.9 | Q192 K193 E194 | F190-Q192 PolarHBondContact O-N 3.42Å; F190-K193 PolarHBondContact O-N 3.07Å; F190-E194 WeakPolarHBondContact O-CB 3.49Å; F190-E194 PolarHBondContact O-N 3.26Å |
| 191 | Q | 78 | Confident | 69.5 | Low | 129 Ų | 129 | 127.4 Ų | 127.4 | 60% | 0.603 | 61% | 0.611 | S | S | * | * | H | α-helix | trans | -61 | -41.2 | 174.9 | -65.9 | -63.6 | -20.7 | 0 | 0 | 113 | S189 K195 | S189-Q191 PolarHBondContact O-N 3.29Å; S189-Q191 VanDerWaalsContact O-N 3.15Å; Q191-K195 VanDerWaalsContact O-CB 3.28Å; Q191-K195 WeakPolarHBondContact O-CB 3.43Å; Q191-K195 PolarHBondContact O-N 3.02Å |
| 192 | Q | 79.1 | Confident | 70.8 | Confident | 98 Ų | 98 | 128.7 Ų | 128.7 | 46% | 0.458 | 61% | 0.606 | S | S | . | * | H | α-helix | trans | -69.6 | -36.4 | 177.1 | -171.8 | 173 | 16.4 | 0 | 0 | 111.7 | E188 S189 F190 R196 | E188-Q192 HydrophobicContact CB-CB 4.23Å; E188-Q192 HydrophobicContact CB-CG 4.23Å; E188-Q192 HydrophobicContact CG-CG 4.27Å; S189-Q192 WeakPolarHBondContact O-CA 3.47Å; S189-Q192 WeakPolarHBondContact O-CB 3.49Å; S189-Q192 PolarHBondContact O-N 2.94Å; S189-Q192 WeakPolarHBondContact OG-CB 3.43Å; S189-Q192 PolarHBondContact OG-N 2.95Å; F190-Q192 PolarHBondContact O-N 3.42Å; Q192-R196 WeakPolarHBondContact O-CB 3.09Å; Q192-R196 PolarHBondContact O-N 3.39Å |
| 193 | K | 80.6 | Confident | 71.6 | Confident | 130 Ų | 130 | 126.8 Ų | 126.8 | 57% | 0.565 | 59% | 0.59 | S | S | * | * | H | α-helix | trans | -70.5 | -40.5 | 175.4 | -166.7 | 172.5 | -176.9 | 178.9 | 0 | 112 | S189 F190 R196 K197 | S189-K193 PolarHBondContact O-N 3.24Å; F190-K193 PolarHBondContact O-N 3.07Å; K193-R196 PolarHBondContact O-N 3.21Å; K193-K197 WeakPolarHBondContact O-CG 3.41Å; K193-K197 PolarHBondContact O-N 3.33Å |
| 194 | E | 82.4 | Confident | 72 | Confident | 75 Ų | 75 | 121.7 Ų | 121.7 | 35% | 0.35 | 58% | 0.575 | S | S | . | * | H | α-helix | trans | -64.8 | -47.6 | 174.8 | -168.5 | -162.1 | 144.3 | 0 | 0 | 111.1 | F190 R196 K197 R198 | F190-E194 WeakPolarHBondContact O-CB 3.49Å; F190-E194 PolarHBondContact O-N 3.26Å; E194-R196 VanDerWaalsContact C-N 3.33Å; E194-R196 PolarHBondContact O-N 3.3Å; E194-K197 PolarHBondContact O-N 3.18Å; E194-K197 VanDerWaalsContact O-N 3.11Å; E194-R198 PolarHBondContact O-N 2.82Å; E194-R198 IonicContact OE1-CZ 3.92Å; E194-R198 IonicContact OE1-NH2 2.82Å; E194-R198 PolarHBondContact OE1-NH2 3.31Å |
| 195 | K | 86.9 | Confident | 72 | Confident | 112 Ų | 112 | 115.6 Ų | 115.6 | 49% | 0.487 | 56% | 0.558 | S | S | . | * | H | α-helix | trans | -57.1 | -46.3 | 173.6 | -176 | 178.5 | -174.6 | -65.6 | 0 | 111.2 | Q191 K197 R198 D199 | Q191-K195 VanDerWaalsContact O-CB 3.28Å; Q191-K195 WeakPolarHBondContact O-CB 3.43Å; Q191-K195 PolarHBondContact O-N 3.02Å; K195-K197 VanDerWaalsContact C-N 3.33Å; K195-K197 PolarHBondContact O-N 3.48Å; K195-R198 PolarHBondContact O-N 3.43Å; K195-D199 IonicContact NZ-OD2 2.76Å; K195-D199 PolarHBondContact NZ-OD2 3.42Å; K195-D199 WeakPolarHBondContact O-CB 3.23Å; K195-D199 VanDerWaalsContact O-CG 3.27Å; K195-D199 PolarHBondContact O-N 3.49Å |
| 196 | R | 82.4 | Confident | 72 | Confident | 121 Ų | 121 | 109.9 Ų | 109.9 | 46% | 0.457 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -61.5 | -40.4 | 176 | -174.8 | -179.6 | -66.1 | 149.6 | 4.7 | 112 | E188 Q192 K193 E194 L200 | E188-R196 IonicContact OE1-CZ 3.16Å; E188-R196 IonicContact OE1-NH1 2.83Å; E188-R196 PolarHBondContact OE1-NH1 3.49Å; E188-R196 IonicContact OE1-NH2 2.62Å; E188-R196 PolarHBondContact OE1-NH2 3.13Å; E188-R196 IonicContact OE2-CZ 3.33Å; E188-R196 IonicContact OE2-NH1 2.7Å; E188-R196 PolarHBondContact OE2-NH1 2.92Å; E188-R196 IonicContact OE2-NH2 3.5Å; Q192-R196 WeakPolarHBondContact O-CB 3.09Å; Q192-R196 PolarHBondContact O-N 3.39Å; K193-R196 PolarHBondContact O-N 3.21Å; E194-R196 VanDerWaalsContact C-N 3.33Å; E194-R196 PolarHBondContact O-N 3.3Å; R196-L200 WeakPolarHBondContact O-CB 3.38Å; R196-L200 PolarHBondContact O-N 3.11Å |
| 197 | K | 83.9 | Confident | 72 | Confident | 154 Ų | 154 | 105.3 Ų | 105.3 | 67% | 0.67 | 53% | 0.533 | S | S | * | . | H | α-helix | trans | -65.1 | -38.7 | 176.6 | -77.3 | -168 | 77.5 | -170.5 | 0 | 112.1 | K193 E194 K195 G201 | K193-K197 WeakPolarHBondContact O-CG 3.41Å; K193-K197 PolarHBondContact O-N 3.33Å; E194-K197 PolarHBondContact O-N 3.18Å; E194-K197 VanDerWaalsContact O-N 3.11Å; K195-K197 VanDerWaalsContact C-N 3.33Å; K195-K197 PolarHBondContact O-N 3.48Å; K197-G201 PolarHBondContact O-N 3.24Å |
| 198 | R | 82.4 | Confident | 72.5 | Confident | 134 Ų | 134 | 101.4 Ų | 101.4 | 51% | 0.506 | 51% | 0.511 | S | S | . | . | H | α-helix | trans | -63.7 | -52.4 | 174.1 | -174.2 | -172.9 | -64.9 | 117.7 | 5 | 111 | E194 K195 L200 G201 Q202 | E194-R198 PolarHBondContact O-N 2.82Å; E194-R198 IonicContact OE1-CZ 3.92Å; E194-R198 IonicContact OE1-NH2 2.82Å; E194-R198 PolarHBondContact OE1-NH2 3.31Å; K195-R198 PolarHBondContact O-N 3.43Å; R198-L200 VanDerWaalsContact C-N 3.29Å; R198-L200 PolarHBondContact O-N 2.95Å; R198-G201 PolarHBondContact O-N 2.83Å; R198-Q202 PolarHBondContact O-N 2.89Å |
| 199 | D | 78.1 | Confident | 72.3 | Confident | 68 Ų | 68 | 104.6 Ų | 104.6 | 36% | 0.364 | 52% | 0.524 | S | S | . | . | H | α-helix | trans | -61.7 | -38.2 | 179.9 | -69 | -5.7 | 0 | 0 | 0 | 110.9 | K195 A203 | K195-D199 IonicContact NZ-OD2 2.76Å; K195-D199 PolarHBondContact NZ-OD2 3.42Å; K195-D199 WeakPolarHBondContact O-CB 3.23Å; K195-D199 VanDerWaalsContact O-CG 3.27Å; K195-D199 PolarHBondContact O-N 3.49Å; D199-A203 VanDerWaalsContact O-CB 3.23Å; D199-A203 WeakPolarHBondContact O-CB 3.38Å; D199-A203 PolarHBondContact O-N 3.38Å |
| 200 | L | 72.8 | Confident | 72.2 | Confident | 112 Ų | 112 | 105.4 Ų | 105.4 | 59% | 0.586 | 53% | 0.526 | S | S | * | . | H | α-helix | trans | -67.6 | -42 | 176.5 | -171.4 | 73.1 | 0 | 0 | 0 | 111.9 | R196 R198 A203 T204 | R196-L200 WeakPolarHBondContact O-CB 3.38Å; R196-L200 PolarHBondContact O-N 3.11Å; R198-L200 VanDerWaalsContact C-N 3.29Å; R198-L200 PolarHBondContact O-N 2.95Å; L200-A203 PolarHBondContact O-N 3.41Å; L200-T204 WeakPolarHBondContact O-CG2 3.28Å; L200-T204 PolarHBondContact O-N 2.97Å; L200-T204 PolarHBondContact O-OG1 3.45Å; L200-T204 VanDerWaalsContact O-OG1 3.13Å |
| 201 | G | 71.6 | Confident | 72.6 | Confident | 43 Ų | 43 | 104.1 Ų | 104.1 | 44% | 0.443 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -65.8 | -36.5 | 176.7 | 0 | 0 | 0 | 0 | 0 | 112.9 | K197 R198 T204 S205 | K197-G201 PolarHBondContact O-N 3.24Å; R198-G201 PolarHBondContact O-N 2.83Å; G201-T204 PolarHBondContact O-OG1 3.42Å; G201-S205 PolarHBondContact O-N 3.17Å |
| 202 | Q | 64.5 | Low | 72.4 | Confident | 124 Ų | 124 | 102.8 Ų | 102.8 | 58% | 0.579 | 52% | 0.516 | S | S | * | . | H | α-helix | trans | -72 | -42.4 | 172.8 | -99.5 | 174.2 | -22.4 | 0 | 0 | 112.5 | R198 T204 S205 | R198-Q202 PolarHBondContact O-N 2.89Å; Q202-T204 PolarHBondContact O-N 3.14Å; Q202-T204 VanDerWaalsContact O-N 3.1Å; Q202-S205 PolarHBondContact O-N 3.39Å; Q202-S205 PolarHBondContact O-OG 3.27Å |
| 203 | A | 62.5 | Low | 72.4 | Confident | 61 Ų | 61 | 103 Ų | 103 | 50% | 0.504 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -65.8 | -14.8 | 178.3 | 0 | 0 | 0 | 0 | 0 | 113.6 | D199 L200 | D199-A203 VanDerWaalsContact O-CB 3.23Å; D199-A203 WeakPolarHBondContact O-CB 3.38Å; D199-A203 PolarHBondContact O-N 3.38Å; L200-A203 PolarHBondContact O-N 3.41Å |
| 204 | T | 59.2 | Low | 72.5 | Confident | 74 Ų | 74 | 103.1 Ų | 103.1 | 45% | 0.454 | 52% | 0.518 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -98.5 | -9.7 | 172.1 | 55.4 | 0 | 0 | 0 | 0 | 114 | L200 G201 Q202 D206 K207 | L200-T204 WeakPolarHBondContact O-CG2 3.28Å; L200-T204 PolarHBondContact O-N 2.97Å; L200-T204 PolarHBondContact O-OG1 3.45Å; L200-T204 VanDerWaalsContact O-OG1 3.13Å; G201-T204 PolarHBondContact O-OG1 3.42Å; Q202-T204 PolarHBondContact O-N 3.14Å; Q202-T204 VanDerWaalsContact O-N 3.1Å; T204-D206 PolarHBondContact O-N 2.99Å; T204-K207 PolarHBondContact O-N 3.1Å |
| 205 | S | 55.7 | Low | 72.3 | Confident | 77 Ų | 77 | 108.1 Ų | 108.1 | 54% | 0.538 | 53% | 0.533 | S | S | . | . | T | Hydrogen-bonded Turn | trans | -65.9 | -27 | -179.6 | 66.2 | 0 | 0 | 0 | 0 | 112.8 | G201 Q202 K207 | G201-S205 PolarHBondContact O-N 3.17Å; Q202-S205 PolarHBondContact O-N 3.39Å; Q202-S205 PolarHBondContact O-OG 3.27Å; S205-K207 PolarHBondContact O-N 3.06Å |
| 206 | D | 57.1 | Low | 72 | Confident | 129 Ų | 129 | 106.6 Ų | 106.6 | 69% | 0.69 | 53% | 0.53 | S | S | * | . | T | Hydrogen-bonded Turn | trans | -80.2 | 0.5 | -178.6 | -57.5 | -11.8 | 0 | 0 | 0 | 112.8 | T204 | T204-D206 PolarHBondContact O-N 2.99Š|
| 207 | K | 61.9 | Low | 71.6 | Confident | 134 Ų | 134 | 106.7 Ų | 106.7 | 58% | 0.583 | 54% | 0.539 | S | S | * | . | trans | -113.6 | 69.8 | 174.3 | -63.5 | 158.7 | -172.8 | 166.3 | 0 | 107.6 | T204 S205 F209 | T204-K207 PolarHBondContact O-N 3.1Å; S205-K207 PolarHBondContact O-N 3.06Å; K207-F209 PolarHBondContact O-N 3.23Å | ||
| 208 | S | 70.4 | Confident | 71.5 | Confident | 56 Ų | 56 | 108.5 Ų | 108.5 | 39% | 0.392 | 54% | 0.541 | S | S | . | . | trans | -57.5 | 116.9 | 162.4 | 177.5 | 0 | 0 | 0 | 0 | 106.5 | V210 E211 E212 | S208-V210 PolarHBondContact O-N 3.29Å; S208-E211 WeakPolarHBondContact O-CA 3.47Å; S208-E211 PolarHBondContact O-N 3.3Å; S208-E212 PolarHBondContact O-N 3.35Å; S208-E212 VanDerWaalsContact O-N 3.1Å | ||
| 209 | F | 66 | Low | 71 | Confident | 139 Ų | 139 | 108.3 Ų | 108.3 | 61% | 0.61 | 55% | 0.546 | S | S | * | . | H | α-helix | trans | -44.8 | -34.8 | 178.8 | 179.3 | -97.6 | 0 | 0 | 0 | 112 | K207 E212 E213 | K207-F209 PolarHBondContact O-N 3.23Å; F209-E212 PolarHBondContact O-N 2.99Å; F209-E213 HydrophobicContact CD1-CG 4.4Å; F209-E213 VanDerWaalsContact CE1-CD 3.5Å; F209-E213 HydrophobicContact CE1-CG 3.99Å; F209-E213 WeakPolarHBondContact CE1-OE1 3.41Å; F209-E213 HydrophobicContact CZ-CG 4.11Å; F209-E213 WeakPolarHBondContact CZ-OE1 3.5Å; F209-E213 WeakPolarHBondContact O-CG 3.38Å; F209-E213 PolarHBondContact O-N 3.01Å |
| 210 | V | 72.6 | Confident | 70.7 | Confident | 84 Ų | 84 | 111 Ų | 111 | 51% | 0.509 | 56% | 0.56 | S | S | . | * | H | α-helix | trans | -65.7 | -38.6 | 176.5 | -179.5 | 0 | 0 | 0 | 0 | 113.4 | S208 K214 | S208-V210 PolarHBondContact O-N 3.29Å; V210-K214 WeakPolarHBondContact O-CG 3.45Å; V210-K214 PolarHBondContact O-N 3.1Å; V210-K214 VanDerWaalsContact O-N 3.17Å |
| 211 | E | 75.9 | Confident | 70.4 | Confident | 133 Ų | 133 | 109.6 Ų | 109.6 | 62% | 0.621 | 57% | 0.565 | S | S | * | * | H | α-helix | trans | -75.3 | -34.4 | 176.2 | -70 | -169.7 | 159.3 | 0 | 0 | 111.8 | S208 K214 R215 | S208-E211 WeakPolarHBondContact O-CA 3.47Å; S208-E211 PolarHBondContact O-N 3.3Å; E211-K214 PolarHBondContact O-N 2.98Å; E211-R215 WeakPolarHBondContact O-CB 3.48Å; E211-R215 PolarHBondContact O-N 3.21Å |
| 212 | E | 74.9 | Confident | 69.5 | Low | 100 Ų | 100 | 117.4 Ų | 117.4 | 47% | 0.467 | 60% | 0.596 | S | S | . | * | H | α-helix | trans | -65.8 | -44.6 | 174.2 | -172.5 | 167 | -157.2 | 0 | 0 | 111.5 | S208 F209 K214 R215 I216 | S208-E212 PolarHBondContact O-N 3.35Å; S208-E212 VanDerWaalsContact O-N 3.1Å; F209-E212 PolarHBondContact O-N 2.99Å; E212-K214 PolarHBondContact O-N 3.44Å; E212-R215 WeakPolarHBondContact O-CB 3.47Å; E212-R215 PolarHBondContact O-N 3.01Å; E212-R215 VanDerWaalsContact O-N 3.14Å; E212-I216 HydrophobicContact CG-CD1 4.14Å; E212-I216 WeakPolarHBondContact O-CG1 3.32Å; E212-I216 PolarHBondContact O-N 2.82Å |
| 213 | E | 78.1 | Confident | 69.7 | Low | 102 Ų | 102 | 117.1 Ų | 117.1 | 48% | 0.477 | 60% | 0.597 | S | S | . | * | H | α-helix | trans | -61.2 | -42.6 | 173.4 | -76.7 | -160.9 | 145 | 0 | 0 | 112.3 | F209 R215 I216 L217 | F209-E213 HydrophobicContact CD1-CG 4.4Å; F209-E213 VanDerWaalsContact CE1-CD 3.5Å; F209-E213 HydrophobicContact CE1-CG 3.99Å; F209-E213 WeakPolarHBondContact CE1-OE1 3.41Å; F209-E213 HydrophobicContact CZ-CG 4.11Å; F209-E213 WeakPolarHBondContact CZ-OE1 3.5Å; F209-E213 WeakPolarHBondContact O-CG 3.38Å; F209-E213 PolarHBondContact O-N 3.01Å; E213-R215 VanDerWaalsContact C-N 3.25Å; E213-R215 PolarHBondContact O-N 3.13Å; E213-I216 PolarHBondContact O-N 3.22Å; E213-L217 WeakPolarHBondContact O-CB 3.43Å; E213-L217 PolarHBondContact O-N 3.26Å |
| 214 | K | 82.1 | Confident | 70.1 | Confident | 134 Ų | 134 | 120.1 Ų | 120.1 | 58% | 0.583 | 60% | 0.602 | S | S | * | * | H | α-helix | trans | -61.8 | -33.1 | 175 | -85.1 | -178.8 | 172.2 | 174.7 | 0 | 112.7 | V210 E211 E212 R218 | V210-K214 WeakPolarHBondContact O-CG 3.45Å; V210-K214 PolarHBondContact O-N 3.1Å; V210-K214 VanDerWaalsContact O-N 3.17Å; E211-K214 PolarHBondContact O-N 2.98Å; E212-K214 PolarHBondContact O-N 3.44Å; K214-R218 WeakPolarHBondContact O-CG 3.38Å; K214-R218 PolarHBondContact O-N 3.1Å |
| 215 | R | 79.8 | Confident | 70.7 | Confident | 180 Ų | 180 | 122.6 Ų | 122.6 | 68% | 0.679 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -71.5 | -45.4 | 176.4 | -171.7 | -178.3 | -158.3 | 153.2 | 6.1 | 111.6 | E211 E212 E213 L217 R218 Q219 | E211-R215 WeakPolarHBondContact O-CB 3.48Å; E211-R215 PolarHBondContact O-N 3.21Å; E212-R215 WeakPolarHBondContact O-CB 3.47Å; E212-R215 PolarHBondContact O-N 3.01Å; E212-R215 VanDerWaalsContact O-N 3.14Å; E213-R215 VanDerWaalsContact C-N 3.25Å; E213-R215 PolarHBondContact O-N 3.13Å; R215-L217 VanDerWaalsContact C-N 3.33Å; R215-L217 PolarHBondContact O-N 2.84Å; R215-R218 PolarHBondContact O-N 2.9Å; R215-Q219 PolarHBondContact O-N 3.35Å |
| 216 | I | 79.3 | Confident | 71.6 | Confident | 80 Ų | 80 | 125.3 Ų | 125.3 | 41% | 0.41 | 62% | 0.615 | S | S | . | * | H | α-helix | trans | -61.1 | -43.7 | 177.8 | -67 | 164.5 | 0 | 0 | 0 | 110.3 | E212 E213 R218 Q219 N220 | E212-I216 HydrophobicContact CG-CD1 4.14Å; E212-I216 WeakPolarHBondContact O-CG1 3.32Å; E212-I216 PolarHBondContact O-N 2.82Å; E213-I216 PolarHBondContact O-N 3.22Å; I216-R218 VanDerWaalsContact C-N 3.29Å; I216-R218 PolarHBondContact O-N 2.78Å; I216-Q219 PolarHBondContact O-N 3.16Å; I216-N220 WeakPolarHBondContact O-CB 3.37Å; I216-N220 VanDerWaalsContact O-CG 3.3Å; I216-N220 PolarHBondContact O-N 2.86Å; I216-N220 PolarHBondContact O-ND2 2.76Å |
| 217 | L | 75.5 | Confident | 72.5 | Confident | 123 Ų | 123 | 125.1 Ų | 125.1 | 64% | 0.644 | 61% | 0.61 | S | S | * | * | H | α-helix | trans | -61.2 | -35.3 | 175.8 | -84.9 | 162.2 | 0 | 0 | 0 | 113.2 | E213 R215 A221 | E213-L217 WeakPolarHBondContact O-CB 3.43Å; E213-L217 PolarHBondContact O-N 3.26Å; R215-L217 VanDerWaalsContact C-N 3.33Å; R215-L217 PolarHBondContact O-N 2.84Å; L217-A221 WeakPolarHBondContact O-CB 3.4Å; L217-A221 PolarHBondContact O-N 2.87Å |
| 218 | R | 80.2 | Confident | 73.2 | Confident | 192 Ų | 192 | 124.5 Ų | 124.5 | 73% | 0.725 | 61% | 0.612 | S | S | * | * | H | α-helix | trans | -73.2 | -38.4 | 174.1 | -72.8 | 174 | -173.3 | -105 | 2.3 | 112.3 | K214 R215 I216 N220 A221 | K214-R218 WeakPolarHBondContact O-CG 3.38Å; K214-R218 PolarHBondContact O-N 3.1Å; R215-R218 PolarHBondContact O-N 2.9Å; I216-R218 VanDerWaalsContact C-N 3.29Å; I216-R218 PolarHBondContact O-N 2.78Å; R218-N220 VanDerWaalsContact C-N 3.33Å; R218-A221 PolarHBondContact O-N 3.29Å |
| 219 | Q | 73.7 | Confident | 73.4 | Confident | 130 Ų | 130 | 129.4 Ų | 129.4 | 61% | 0.607 | 63% | 0.628 | S | S | * | * | H | α-helix | trans | -68.3 | -29.9 | 176.8 | -81.4 | -170.4 | -50.6 | 0 | 0 | 113.5 | R215 I216 A221 | R215-Q219 PolarHBondContact O-N 3.35Å; I216-Q219 PolarHBondContact O-N 3.16Å; Q219-A221 VanDerWaalsContact C-N 3.28Å |
| 220 | N | 71.2 | Confident | 74 | Confident | 125 Ų | 125 | 128.6 Ų | 128.6 | 67% | 0.668 | 63% | 0.629 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -84.3 | -3.3 | 176.9 | -66.9 | -20.5 | 0 | 0 | 0 | 113.3 | I216 R218 | I216-N220 WeakPolarHBondContact O-CB 3.37Å; I216-N220 VanDerWaalsContact O-CG 3.3Å; I216-N220 PolarHBondContact O-N 2.86Å; I216-N220 PolarHBondContact O-ND2 2.76Å; R218-N220 VanDerWaalsContact C-N 3.33Å |
| 221 | A | 66.5 | Low | 74.1 | Confident | 82 Ų | 82 | 132.3 Ų | 132.3 | 68% | 0.678 | 64% | 0.639 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -98.9 | -6.9 | 179.4 | 0 | 0 | 0 | 0 | 0 | 113.4 | L217 R218 Q219 | L217-A221 WeakPolarHBondContact O-CB 3.4Å; L217-A221 PolarHBondContact O-N 2.87Å; R218-A221 PolarHBondContact O-N 3.29Å; Q219-A221 VanDerWaalsContact C-N 3.28Å |
| 222 | D | 51.9 | Low | 73.9 | Confident | 207 Ų | 207 | 132.3 Ų | 132.3 | 100% | 1.107 | 64% | 0.64 | S | S | * | * | trans | -96.7 | 0 | 164.9 | -74.6 | -35.8 | 0 | 0 | 0 | 110 |
Retrieved 222 of 222 residues in 788.3 ms
(Link to these results)